SCHEMBL2467449

SCHEMBL2467449

CC(C)Cc1ccc2cnncc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.47
GABRA1 P14867 1/20 0.44
GABRB2 P47870 1/20 0.44
HTR2A P28223 2/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
XDH P47989 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.35
ALB P02768 1/20 0.35
ESR1 P03372 1/20 0.35
ALOX5 P09917 1/20 0.35
RARB P10826 1/20 0.35
CYP2C9 P11712 1/20 0.35
ADRB3 P13945 1/20 0.35
NFKB1 P19838 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
AKR1C3 P42330 1/20 0.35
NR1I3 Q14994 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28292686 0.83 HTR2A (0.57) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL21037208 0.80 ABL1 (0.39) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL18417279 0.79 CYP19A1 (0.50) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL18417282 0.79 CYP19A1 (0.50) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL30286452 0.79 CYP19A1 (0.50) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL18899826 0.78 ABL1 (0.56) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL17253659 0.78 ABL1 (0.49) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL8240107 0.77 CYP1A2 (0.56) ALDH1A1LMNAAKR1C3
SCHEMBL17229344 0.77 ABL1 (0.45) ABL1GABRA1GABRB2HTR2AHTR2C
SCHEMBL14511412 0.77 PDPK1 (0.47) ABL1GABRA1GABRB2HTR2AHTR2C

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 151 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217990-A1 THIENOPYRROLE COMPOUNDS GILEAD SCIENCES, INC. 2024-07-04 US disclosed
US-20220125786-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION GLOBAL BLOOD THERAPEUTICS INC (US) 2022-04-28 US disclosed
US-20210130473-A1 TGFßR1 INHIBITOR-ASGR ANTIBODY CONJUGATES AND USES THEREOF SILVERBACK THERAPEUTICS, INC. 2021-05-06 US disclosed
US-20210032229-A1 PYRIDINE RING-SUBSTITUTED PYRIDAZINOL COMPOUNDS AND DERIVATIVES, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND APPLICATIONS THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2021-02-04 US disclosed
US-10806733-B2 Substituted benzaldehyde compounds and methods for their use in increasing tissue oxygenation GLOBAL BLOOD THERAPEUTICS, INC. (US) 2020-10-20 US disclosed
US-20200048288-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-02-13 US disclosed
US-20190160060-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION GLOBAL BLOOD THERAPEUTICS, INC. 2019-05-30 US disclosed
EP-3224252-B1 SUBSTITUTED OXAZOLE- AND THIAZOLE-BASED CARBOXAMIDE AND UREA DERIVATIVES AS VANILLOID RECEPTOR LIGANDS II MEDIFRON DBT INC (KR) 2019-01-09 EP disclosed
WO-2018115069-A1 NITROGEN CONTAINING BICYCLIC DERIVATIVES FOR TREATING PAIN AND PAIN RELATED CONDITIONS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2018-06-28 WO disclosed
EP-3339307-A1 NITROGEN CONTAINING BICYCLIC DERIVATIVES FOR TREATING PAIN AND PAIN RELATED CONDITIONS Laboratorios del Dr. Esteve, S.A. (ES) 2018-06-27 EP disclosed
US-6153372-A CONTAINING ORGANIC SILVER SALT, PHOTOSENSITIVE SILVER HALIDE EMULSION, BINDER AND IMAGE FORMING LAYER FUJI PHOTO FILM CO., LTD. (JP) 2000-11-28 US disclosed
US-6150084-A NUCLEATING AGENT AND DIPHOSPHORUS PENTOXIDE-DERIVED COMPOUND; ANTIFOGGING AGENT, CONTRAST FUJI PHOTO FILM CO., LTD. (JP) 2000-11-21 US disclosed
US-6140038-A Heat-developable image-recording material FUJI PHOTO FILM CO., LTD (JP) 2000-10-31 US disclosed
EP-1045284-A1 Heat developing method for heat developable image recording material FUJI PHOTO FILM CO., LTD. (JP) 2000-10-18 EP disclosed
EP-1041433-A1 Heat-developable photosensitive material and method for forming image using the same FUJI PHOTO FILM CO., LTD. (JP) 2000-10-04 EP disclosed
EP-1041435-A1 Heat-developable photographic material FUJI PHOTO FILM CO., LTD. (JP) 2000-10-04 EP disclosed
EP-1041434-A1 Heat-developable photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 2000-10-04 EP disclosed
US-6100022-A COMPRISES A NONPHOTOSENSITIVE ORGANIC SILVER SALT, A PHOTOSENSITIVE SILVER HALIDE AND A POLYMERIC BINDER HAVING GLASS TRANSITION TEMPERATURE OF-30 TO 40 DEGREE C. ON A SUPPORT, AND IMAGE FORMING LAYER CONTAINING NUCLEATING AGENT FUJI PHOTO FILM CO., LTD. (JP) 2000-08-08 US disclosed
EP-1020760-A2 Heat developable image recording material FUJI PHOTO FILM CO., LTD. (JP) 2000-07-19 EP disclosed
US-6060228-A BACKING LAYER CONTAINS A METHINE DYE HAVING SPECIFIC MAXIMUM ABSORPTION WAVELENGTH FUJI PHOTO FILM CO., LTD. (JP) 2000-05-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10806733-B2 Substituted benzaldehyde compounds and methods for their use in increasing tissue oxygenation HBB, HBG2, MB ABL1 542/4885GABRA1 639/4885GABRB2 261/4885
US-20210032229-A1 PYRIDINE RING-SUBSTITUTED PYRIDAZINOL COMPOUNDS AND DERIVATIVES, PREPARATION METHODS, HERBICIDAL COMPOSITIONS AND APPLICATIONS THEREOF CBR3, CBR1, H1-0 ABL1 943/4885GABRA1 2235/4885GABRB2 1886/4885
US-20240217990-A1 THIENOPYRROLE COMPOUNDS SSB, TPMT, LCP2 ABL1 692/4885GABRA1 2876/4885GABRB2 2487/4885
US-20220125786-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION HBB, HBG2, MB ABL1 542/4885GABRA1 639/4885GABRB2 261/4885
US-20210130473-A1 TGFßR1 INHIBITOR-ASGR ANTIBODY CONJUGATES AND USES THEREOF TGFBR2, ASGR1, TGFBR1 ABL1 1118/4885GABRA1 405/4885GABRB2 508/4885
US-20200048288-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 ABL1 16/4885GABRA1 4233/4885GABRB2 4116/4885
US-20190160060-A1 SUBSTITUTED BENZALDEHYDE COMPOUNDS AND METHODS FOR THEIR USE IN INCREASING TISSUE OXYGENATION HBB, HBG2, MB ABL1 542/4885GABRA1 639/4885GABRB2 261/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.