SCHEMBL482703

SCHEMBL482703

C[C](C)C(C)CCC(C)C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.42
LMNA P02545 1/20 0.38
CA1 P00915 2/20 0.33
TSHR P16473 1/20 0.33
PTPN1 P18031 1/20 0.32
GABRR1 P24046 2/20 0.32
CYP1A2 P05177 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 1/20 0.30

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
SCHEMBL5197231 0.75 BLM (0.34) BLMCA1TSHR
SCHEMBL28478835 0.75 BLM (0.30) BLM
SCHEMBL1784505 0.75 BLM (0.44) BLMCA1GABRR1CYP1A2ALDH1A1
Hydrogen Peroxide SCHEMBL9341267 0.73 TSHR (0.46) BLMLMNACA1TSHRCYP1A2
SCHEMBL10696984 0.73
SCHEMBL99840 0.73
SCHEMBL21931322 0.73 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL3336438 0.73 ACE2 (0.35) BLMTSHR
SCHEMBL83493 0.73
SCHEMBL16469013 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3558986-A1 SUBSTITUTED 1,2,4-THIADIAZOLYL PYRROLONES AND 1,2,4-THIADIAZOLYL HYDANTOINES AND SALTS THEREOF AND USE THEREOF AS HERBICIDES Bayer CropScience Aktiengesellschaft (DE) 2019-10-30 EP claimed
EP-4196267-A1 NOVEL RUTHENIUM COMPLEXES, METHODS OF THEIR PREPARATION AND APPLICATION THEREOF IN OLEFIN CROSS METATHESIS Apeiron Synthesis S.A. (PL) 2023-06-21 EP disclosed
WO-2022038121-A1 NOVEL RUTHENIUM COMPLEXES, METHODS OF THEIR PREPARATION AND APPLICATION THEREOF IN OLEFIN CROSS METATHESIS APEIRON SYNTHESIS S.A. (PL) 2022-02-24 WO disclosed
WO-2021130622-A2 RUTHENIUM COMPLEX AND METHOD OF CONDUCTING OLEFIN METATHESIS REACTIONS WITH FORMATION OF AN INTERNAL BOND USING THE RUTHENIUM COMPLEX AS A CATALYST APEIRON SYNTHESIS S.A. (PL) 2021-07-01 WO disclosed
EP-2718016-B1 NEW COMPLEXES OF RUTHENIUM, METHOD FOR THEIR PREPARATION, AND THEIR APPLICATION IN OLEFIN METATHESIS REACTIONS UMICORE AG & CO KG (DE) 2019-08-14 EP disclosed
EP-3262056-A2 ANTISENSE-INDUCED EXON2 INCLUSION IN ACID ALPHA-GLUCOSIDASE Sarepta Therapeutics, Inc. (US) 2018-01-03 EP disclosed
US-9802927-B2 Oxadiazine compounds and methods of use thereof DENALI THERAPEUTICS, INC. (US) 2017-10-31 US disclosed
WO-2017184529-A1 ANTISENSE OLIGOMERS AND METHODS OF USING THE SAME FOR TREATING DISEASES ASSOCIATED WITH THE ACID ALPHA-GLUCOSIDASE GENE SAREPTA THERAPEUTICS, INC. (US) 2017-10-26 WO disclosed
US-9771378-B2 Fused morpholinopyrimidines and methods of use thereof DENALI THERAPEUTICS, INC. (US) 2017-09-26 US disclosed
US-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF DENALI THERAPEUTICS, INC. 2017-03-09 US disclosed
EP-1505125-A1 Cyanine compound, optical recording material, and optical recording medium Asahi Denka Co., Ltd. (JP) 2005-02-09 EP disclosed
US-20040197705-A1 Cyanide compound, optical filter, and optical recording material ASAHI DENKA CO., LTD. (JP) 2004-10-07 US disclosed
EP-1464678-A1 Cyanine compound, optical filter, and optical recording material Asahi Denka Co., Ltd. (JP) 2004-10-06 EP disclosed
EP-1129068-A1 BICYCLIC SIGNAL TRANSDUCTION INHIBITORS, COMPOSITION CONTAINING THEM AND USES THEREOF ARIAD PHARMACEUTICALS, INC. (US) 2001-09-05 EP disclosed
EP-1053241-A1 NOVEL DIMERIZING AGENTS, THEIR PRODUCTION AND USE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2000-11-22 EP disclosed
EP-1030853-A1 NOVEL SIGNAL TRANSDUCTION INHIBITORS, COMPOSITIONS CONTAINING THEM ARIAD PHARMACEUTICALS, INC. (US) 2000-08-30 EP disclosed
WO-2000027802-A1 BICYCLIC SIGNAL TRANSDUCTION INHIBITORS, COMPOSITIONS CONTAINING THEM & USES THEREOF ARIAD PHARMACEUTICALS, INC. (US) 2000-05-18 WO disclosed
WO-1999041258-A1 NOVEL DIMERIZING AGENTS, THEIR PRODUCTION AND USE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1999-08-19 WO disclosed
WO-1999024442-A1 NOVEL SIGNAL TRANSDUCTION INHIBITORS, COMPOSITIONS CONTAINING THEM ARIAD PHARMACEUTICALS, INC. (US) 1999-05-20 WO disclosed
US-5706829-A BENZODIAZEPINE DERIVATIVE CREIGHTON UNIVERSITY (US) 1998-01-13 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 (2 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-20170066753-A1 OXADIAZINE COMPOUNDS AND METHODS OF USE THEREOF PSEN2, SMN1; SMN2, OTC BLM 1161/4885LMNA 2961/4885CA1 1239/4885
US-20040197705-A1 Cyanide compound, optical filter, and optical recording material HCN4, HCN2, HCN1 BLM 3104/4885LMNA 1862/4885CA1 94/4885

“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.