SCHEMBL7095421

SCHEMBL7095421

O=c1c2cccnc2sc(=Nc2ccc(Cl)cc2)n1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 7/20 0.51
EP300 Q09472 3/20 0.51
CREBBP Q92793 3/20 0.51
KAT2A Q92830 3/20 0.51
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
TP53 P04637 1/20 0.45
THRB P10828 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
LIPG Q9Y5X9 1/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL7095419 1.00 KAT2B (0.51) KAT2BEP300CREBBPKAT2AALDH1A1
SCHEMBL7101449 0.93 KAT2B (0.54) KAT2BEP300CREBBPKAT2AALDH1A1
SCHEMBL7101446 0.93 KAT2B (0.54) KAT2BEP300CREBBPKAT2AALDH1A1
SCHEMBL7096007 0.90 KAT2B (0.49) KAT2BEP300CREBBPKAT2AALDH1A1
SCHEMBL7096565 0.90 KAT2B (0.49) KAT2BEP300CREBBPKAT2AALDH1A1
SCHEMBL7096005 0.90 KAT2B (0.49) KAT2BEP300CREBBPKAT2AALDH1A1
SCHEMBL7096657 0.90 KAT2B (0.52) KAT2BALDH1A1SMN1; SMN2PDE4APDE4B
SCHEMBL7096564 0.90 KAT2B (0.49) KAT2BEP300CREBBPKAT2AALDH1A1
SCHEMBL7096656 0.90 KAT2B (0.52) KAT2BALDH1A1SMN1; SMN2PDE4APDE4B
SCHEMBL7100432 0.87 KAT2B (0.54) KAT2BEP300CREBBPKAT2APDE4A

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