SCHEMBL7672583

SCHEMBL7672583

NC(=O)Oc1nc2ccc(C(=O)Nc3ccc4ccccc4c3)cc2s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 17/20 0.54
NPC1 O15118 16/20 0.54
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
CASP3 P42574 4/20 0.52
SENP7 Q9BQF6 4/20 0.52
NQO2 P16083 1/20 0.52
HDAC1 Q13547 1/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 2/20 0.48
POLB P06746 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HTT P42858 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
KDM4E B2RXH2 2/20 0.47
SENP6 Q9GZR1 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SENP8 Q96LD8 1/20 0.46

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
SCHEMBL7627377 0.86 RAB9A (0.56) RAB9ANPC1ALDH1A1LMNAMEN1
SCHEMBL7626917 0.84 NPC1 (0.49) RAB9ANPC1ALDH1A1LMNARXFP1
SCHEMBL7623677 0.83 RAB9A (0.50) RAB9ANPC1ALDH1A1LMNACASP3
SCHEMBL7647123 0.82 PLAU (0.54) RAB9ANPC1ALDH1A1LMNACASP3
SCHEMBL7626085 0.81 LCK (0.49) RAB9ANPC1ALDH1A1LMNA
SCHEMBL7632422 0.80 RAB9A (0.53) RAB9ANPC1ALDH1A1LMNAMEN1
SCHEMBL7631048 0.79 LCK (0.61) ALDH1A1
SCHEMBL6058291 0.79 HTT (0.61) RAB9ANPC1ALDH1A1LMNACASP3
SCHEMBL7626952 0.77 RAB9A (0.55) RAB9ANPC1ALDH1A1LMNAMEN1
SCHEMBL7631046 0.77 LCK (0.70)

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-1037632-A4 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2002-08-21 EP disclosed
EP-1037632-A1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2000-09-27 EP disclosed
WO-1999024035-A1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-05-20 WO disclosed