SCHEMBL7447422

SCHEMBL7447422

CC(=O)c1ccc2ccncc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.55
HASPIN Q8TF76 1/20 0.48
HIPK2 Q9H2X6 1/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
IMPDH2 P12268 2/20 0.45
HSF1 Q00613 1/20 0.44
LCK P06239 1/20 0.44
CSF1R P07333 1/20 0.44
KDR P35968 1/20 0.44
MAPK14 Q16539 1/20 0.44
NAMPT P43490 1/20 0.44
SMYD3 Q9H7B4 1/20 0.43
PRKCZ Q05513 1/20 0.43
RAPGEF3 O95398 1/20 0.43
NPC1 O15118 2/20 0.43

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
SCHEMBL30134313 1.00 CYP2A6 (0.55) CYP2A6HASPINHIPK2ALDH1A1MAPT
SCHEMBL3126130 0.93 IMPDH2 (0.53) CYP2A6HASPINHIPK2ALDH1A1MAPT
SCHEMBL1403704 0.83 MRGPRX4 (0.56) HIPK2ALDH1A1HDAC3HDAC1HDAC2
SCHEMBL29488886 0.83 MRGPRX4 (0.56) HIPK2ALDH1A1HDAC3HDAC1HDAC2
Potassium SCHEMBL6984080 0.81 MRGPRX4 (0.55) HIPK2ALDH1A1HDAC3HDAC1HDAC2
SCHEMBL6648425 0.81 AR (0.55) HIPK2HDAC3HDAC1HDAC2LCK
SCHEMBL13752401 0.81 PRKCZ (0.43) HASPINHIPK2HDAC3HDAC1HDAC2
SCHEMBL6984075 0.81 MRGPRX4 (0.55) HIPK2ALDH1A1HDAC3HDAC1HDAC2
Hydrochloric Acid SCHEMBL29816771 0.81 MRGPRX4 (0.55) HIPK2ALDH1A1HDAC3HDAC1HDAC2
SCHEMBL29972759 0.81 AR (0.55) HIPK2HDAC3HDAC1HDAC2LCK

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240300951-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-09-12 US disclosed
US-20240270751-A1 Pyrazolopyridinone Compounds BEIGENE LTD. (KY) 2024-08-15 US disclosed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN disclosed
EP-3341007-B1 MALT1 INHIBITORS AND USES THEREOF UNIV CORNELL (US) 2020-12-23 EP disclosed
EP-3092229-B1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-03-28 EP disclosed
WO-2017040304-A1 MALT1 INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2017-03-09 WO disclosed
US-20160326108-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL MYERS SQUIBB CO (US) 2016-11-10 US disclosed
US-9458171-B2 Pyrrolidinyl sulfone RORγ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2016-10-04 US disclosed
US-20150191483-A1 PYRROLIDINYL SULFONE RORGAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2015-07-09 US disclosed
US-20110294789-A1 COMPOUNDS FOR RHO KINASE INHIBITION AND FOR IMPROVING LEARNING AND MEMORY AMNESTIX, INC. 2011-12-01 US disclosed
US-6399627-B1 ANTICOAGULANTS; PROTHROMINASE, SERINE PROTEASE INHIBITOR; ACRYLAMIDE DERIVATIVES COR THERAPEUTICS, INC. 2002-06-04 US disclosed
EP-1189879-A1 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2002-03-27 EP disclosed
EP-1159264-A2 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2001-12-05 EP disclosed
WO-2000071512-A1 INHIBITORS OF FACTOR Xa COR THERAPEUTICS, INC. (US) 2000-11-30 WO disclosed
WO-2000047554-A2 INHIBITORS OF FACTOR Xa COR THERAPEUTICS INC. (US) 2000-08-17 WO 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-20110294789-A1 COMPOUNDS FOR RHO KINASE INHIBITION AND FOR IMPROVING LEARNING AND MEMORY ROCK1, IRAK1, ROCK2 CYP2A6 4605/4885HASPIN 840/4885HIPK2 176/4885
US-20240300951-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK CYP2A6 3696/4885HASPIN 2056/4885HIPK2 2827/4885
US-20240270751-A1 Pyrazolopyridinone Compounds NFATC1, CD4, PBK CYP2A6 3696/4885HASPIN 2056/4885HIPK2 2827/4885
US-20160326108-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS RORC, RORB, RORA CYP2A6 415/4885HASPIN 4545/4885HIPK2 3686/4885
US-20150191483-A1 PYRROLIDINYL SULFONE RORGAMMA MODULATORS RORC, RORB, RORA CYP2A6 392/4885HASPIN 4555/4885HIPK2 3783/4885

“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.