SCHEMBL2008459

SCHEMBL2008459

Nc1ccc2cccn2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.50
RAB9A P51151 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 4/20 0.32
MAPT P10636 3/20 0.32
POLB P06746 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 3/20 0.32
CASP1 P29466 2/20 0.32
RECQL P46063 1/20 0.32
MEN1 O00255 1/20 0.32
HSD17B10 Q99714 2/20 0.31
GFER P55789 1/20 0.31
NAMPT P43490 1/20 0.31
CASP7 P55210 1/20 0.30
HBB P68871 1/20 0.30
HIF1A Q16665 1/20 0.30
TDP1 Q9NUW8 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
Hydrochloric Acid SCHEMBL29243433 0.98 ALOX15 (0.48) ALOX15RAB9AKMT2AALDH1A1MAPT
SCHEMBL12872525 0.78 CYP3A4 (0.50) ALOX15RAB9AKMT2AALDH1A1MAPT
SCHEMBL12872514 0.78 ALDH1A1 (0.50) ALOX15RAB9AKMT2AALDH1A1MAPT
SCHEMBL2010685 0.74 ALOX15 (0.48) ALOX15RAB9AKMT2AALDH1A1MAPT
SCHEMBL24097278 0.71 ALOX15 (0.50) ALOX15RAB9AKMT2AALDH1A1MAPT
SCHEMBL20955977 0.71 ALOX15 (0.50) ALOX15RAB9AKMT2AALDH1A1MAPT
SCHEMBL276215 0.71 ALOX15 (0.50) ALOX15RAB9AALDH1A1MAPTPOLB
SCHEMBL4566858 0.71 ALOX15 (0.50) ALOX15RAB9AKMT2AALDH1A1MAPT
SCHEMBL2008456 0.71 ALOX15 (0.50) ALOX15RAB9AALDH1A1MAPTPOLB
SCHEMBL2009547 0.71 ALOX15 (0.50) ALOX15RAB9AKMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118119626-A Fused bicyclic heteroaryl compounds useful as NLRP3 inhibitors 豪夫迈·罗氏有限公司 2024-05-31 CN disclosed
US-7964623-B2 Tricyclic benzopyrane compound NISSAN CHEMICAL INDUSTRIES LTD. (JP) 2011-06-21 US disclosed
US-20100081808-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE EPOXY COMPOUND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-04-01 US disclosed
US-20100069374-A1 Tricyclic benzopyrane compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-03-18 US disclosed
US-7652008-B2 2,2,7,9-tetramethyl-4-[(2-phenylethyl)amino]-3,4-dihydro-2H-pyrano[2,3-g]quinolin-3-ol; 3-hydroxy-2,2,9-trimethyl-4-[(2-phenylethyl)amino]-3,4-dihydro-2H-pyrano[2,3-g]quinolin-7-carbonitrile; have the prolongation effect on refractory period NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-01-26 US disclosed
EP-2133343-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE EPOXY COMPOUND Nissan Chemical Industries, Ltd. (JP) 2009-12-16 EP disclosed
US-20080004262-A1 Tricyclic Benzopyrane Compound as Anti-Arrhythmic Agents NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-01-03 US disclosed
EP-1732929-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS Nissan Chemical Industries, Ltd. (JP) 2006-12-20 EP disclosed
WO-2005090357-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-29 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 (3 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-20100069374-A1 Tricyclic benzopyrane compound CBR1, CBR3, CYP2C9 ALOX15 2356/4885RAB9A 774/4885KMT2A 3664/4885
US-20100081808-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE EPOXY COMPOUND OSTC, EEF1D, SQLE ALOX15 73/4885RAB9A 427/4885KMT2A 3245/4885
US-20080004262-A1 Tricyclic Benzopyrane Compound as Anti-Arrhythmic Agents CBR1, CBR3, SCN8A ALOX15 2135/4885RAB9A 964/4885KMT2A 3585/4885

“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.