SCHEMBL4406312

SCHEMBL4406312

CC(=O)c1ccc(NN)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
RAB9A P51151 4/20 0.53
NPC1 O15118 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TAAR1 Q96RJ0 1/20 0.53
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
HTT P42858 1/20 0.52
NLRP1 Q9C000 1/20 0.52
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
CYP1A1 P04798 1/20 0.50
CYP1B1 Q16678 1/20 0.50
STS P08842 1/20 0.48
NOS3 P29474 3/20 0.48
NOS1 P29475 3/20 0.48
HPGD P15428 2/20 0.48
LMNA P02545 1/20 0.48

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
Acetophenone SCHEMBL28186726 0.85 CYP1A2 (0.58) MAPTRAB9ANPC1SMN1; SMN2TAAR1
4-Hydroxyacetophenone SCHEMBL11444527 0.82 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2TAAR1
SCHEMBL6906973 0.80 RAB9A (0.60) MAPTRAB9ANPC1SMN1; SMN2TAAR1
SCHEMBL29043036 0.80 MAPT (0.57) MAPTRAB9ANPC1SMN1; SMN2TAAR1
SCHEMBL4853473 0.80 MAPK13 (0.52) MAPTRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL50646 0.79 MAPT (0.68) MAPTRAB9ANPC1SMN1; SMN2TAAR1
SCHEMBL24206451 0.78 MAPT (0.44) MAPTRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL7034 0.78 TSHR (0.60) MAPTRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL11353187 0.78 ALDH1A1 (0.52) MAPTSMN1; SMN2KMT2ACA1CA2
SCHEMBL912761 0.78 KMT2A (0.56) MAPTRAB9ANPC1SMN1; SMN2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3268038-B1 ANTIBODY DRUG CONJUGATES (ADC) THAT BIND TO FLT3 PROTEINS AGENSYS INC (US) 2021-05-05 EP claimed
CN-112574077-B Method for synthesizing sulfone compound under photocatalysis condition 河南大学 2022-02-22 CN disclosed
US-11147815-B2 Compositions and methods for treating diseases associated with uncontrolled inflammatory responses SYNKRINO BIOTHERAPEUTICS, INC. 2021-10-19 US disclosed
CN-112574077-A Method for synthesizing sulfone compound under photocatalysis condition 河南大学 2021-03-30 CN disclosed
EP-2797417-B1 SELECTIVE INHIBITION OF PHOSPHOENOLPYRUVATE CARBOXYLASES OF C4 PLANTS HEINRICH HEINE UNIV DUESSELDORF (DE) 2019-07-31 EP disclosed
CN-105801544-A 3-aryl-4-arylamine-coumarin derivative and preparing method and medical application thereof 中国药科大学 2016-07-27 CN disclosed
US-20160031812-A1 SEPIAPTERIN REDUCTASE INHIBITORS FOR THE TREATMENT OF PAIN SOLACE PHARMACEUTICALS UK LTD. (GB) 2016-02-04 US disclosed
US-9169234-B2 Sepiapterin reductase inhibitors for the treatment of pain CHILDREN'S MEDICAL CENTER CORPORATION (US) 2015-10-27 US disclosed
US-8729228-B2 Method of producing a modified (poly) peptide UNIVERSITY OF GENEVA (CH) 2014-05-20 US disclosed
EP-1979371-B1 METHOD OF PRODUCING A MODIFIED (POLY)PEPTIDE UNIV GENEVE (CH) 2013-02-27 EP disclosed
US-20070048217-A1 F-18 peptides for pre targeted positron emission tomography imaging IMMUNOMEDICS, INC. 2007-03-01 US disclosed
US-20070026535-A1 Novel methodology of conjugating chelators to biomolecules KPL, INC. (US) 2007-02-01 US disclosed
US-6534041-B1 Having little or no fluorescence emission until dye is cleaved from construct at tumor or inflammation target site INSTITUTE FOR DIAGNOSTIC RESEARCH GMBH OF THE FREE UNIVERSITY OF BERLIN (DE) 2003-03-18 US disclosed
US-20010044553-A1 Novel compound for color-producing composition, and recording material CHEMIPRO KASEI KAISHA, LTD. (JP) 2001-11-22 US disclosed
CN-1253507-A Acid-labile and enzymatically divisible dye structure for diagnosis with near infrared light and for therapy DIAGNOSTIKFORSCHUNG INST (DE) 2000-05-17 CN disclosed
EP-0988060-A2 ACID-LABILE AND ENZYMATICALLY DIVISIBLE DYE COMPOUNDS FOR DIAGNOSIS WITH NEAR INFRARED LIGHT AND FOR THERAPY INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) 2000-03-29 EP disclosed
WO-1998047538-A2 ACID-LABILE AND ENZYMATICALLY DIVISIBLE DYE COMPOUNDS FOR DIAGNOSIS WITH NEAR INFRARED LIGHT AND FOR THERAPY Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 1998-10-29 WO disclosed
US-5106814-A Containing aromatic isocyanate, imino compound, trialkoxy benzoate; image stability, responsiveness MITSUBISHI PAPER MILLS LIMITED (JP) 1992-04-21 US disclosed
US-4448961-A Substituted anilino pyrimidines ZOECON CORPORATION (US) 1984-05-15 US disclosed
US-4411839-A α-Cyano-β-(trisubstituted phenylhydrazino)-n-ethoxycarbonylacrylamides ZOECON CORPORATION (US) 1983-10-25 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 (5 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-20160031812-A1 SEPIAPTERIN REDUCTASE INHIBITORS FOR THE TREATMENT OF PAIN SPR, QDPR, SRR MAPT 2193/4885RAB9A 3428/4885NPC1 2778/4885
US-20070048217-A1 F-18 peptides for pre targeted positron emission tomography imaging SSTR4, NPPA, ANPEP MAPT 2678/4885RAB9A 977/4885NPC1 1363/4885
US-11147815-B2 Compositions and methods for treating diseases associated with uncontrolled inflammatory responses TRIM28, TRIM58, CD14 MAPT 1064/4885RAB9A 2830/4885NPC1 2530/4885
US-20070026535-A1 Novel methodology of conjugating chelators to biomolecules SLC40A1, SLC30A6, CACYBP MAPT 3496/4885RAB9A 2392/4885NPC1 1574/4885
US-20010044553-A1 Novel compound for color-producing composition, and recording material UROD, UMPS, UGT1A10 MAPT 979/4885RAB9A 1884/4885NPC1 4665/4885

“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.