SCHEMBL7097091

SCHEMBL7097091

CCn1c(=Nc2ccc(Cl)cc2)sc2ncccc2c1=O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 8/20 0.47
EP300 Q09472 3/20 0.47
CREBBP Q92793 3/20 0.47
KAT2A Q92830 3/20 0.47
TP53 P04637 1/20 0.39
KDM4E B2RXH2 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
THRB P10828 1/20 0.38
ALDH1A1 P00352 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ADORA2A P29274 1/20 0.36

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
SCHEMBL7099274 1.00 KAT2B (0.47) KAT2BEP300CREBBPKAT2ATP53
SCHEMBL7098771 0.91 KAT2B (0.46) KAT2BEP300CREBBPKAT2ATP53
SCHEMBL7097076 0.91 KAT2B (0.46) KAT2BEP300CREBBPKAT2ATP53
SCHEMBL7099940 0.89 KAT2B (0.47) KAT2BTP53CA12CA1CA2
SCHEMBL7099943 0.89 KAT2B (0.47) KAT2BTP53CA12CA1CA2
SCHEMBL7096641 0.89 KAT2B (0.43) KAT2BKDM4EKMT2AALDH1A1
SCHEMBL7096644 0.89 KAT2B (0.43) KAT2BKDM4EKMT2AALDH1A1
SCHEMBL7096660 0.88 KAT2B (0.41) KAT2BEP300CREBBPKAT2ATP53
SCHEMBL7096659 0.88 KAT2B (0.41) KAT2BEP300CREBBPKAT2ATP53
SCHEMBL7096891 0.87 POLB (0.48) KAT2BEP300CREBBPKAT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0878196-B1 KAINIC ACID NEURONOTOXICITY INHIBITORS AND PYRIDOTHIAZINE DERIVATIVES YAMANOUCHI PHARMA CO LTD (JP) 2003-09-03 EP disclosed
US-6133258-A PYRIDOTHIAZINE DERIVATIVE; FOR TREATMENT OF AMYOTROPHIC LATERAL SCLEROSIS, MULTIPLE SCLEROSIS, PAIN, GLAUCOMA YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2000-10-17 US disclosed
EP-0878196-A1 KAINIC ACID NEURONOTOXICITY INHIBITORS AND PYRIDOTHIAZINE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1998-11-18 EP disclosed