SCHEMBL7629155

SCHEMBL7629155

CCCc1ccc(C)c(NC(=O)c2ccc3nc(OC(N)=O)sc3c2)c1C

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 18/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL7631048 0.83 LCK (0.61) LCK
SCHEMBL7627306 0.81 ALDH1A1 (0.49) LCKMEN1KMT2ANPC1MAPT
SCHEMBL7623796 0.81 LCK (0.52) LCKMEN1KMT2A
SCHEMBL7631046 0.81 LCK (0.70) LCK
SCHEMBL7626085 0.80 LCK (0.49) LCKNPC1RAB9A
SCHEMBL7626181 0.79 LCK (0.62) LCK
SCHEMBL7628467 0.79 LCK (0.67) LCK
SCHEMBL7624309 0.79 ALDH1A1 (0.52) LCKSMN1; SMN2
SCHEMBL7632108 0.77 LCK (0.64) LCK
SCHEMBL7633894 0.76 LCK (0.60) LCKMEN1KMT2ANPC1RAB9A

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