SCHEMBL6058008

SCHEMBL6058008

Cc1cccc(C)c1NC(=O)c1ccc2n[c]sc2c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 17/20 0.56
S1PR4 O95977 1/20 0.50
TP53 P04637 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
FYN P06241 1/20 0.47
SRC P12931 1/20 0.47

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
SCHEMBL6058429 0.90 LCK (0.61) LCK
SCHEMBL7452674 0.82 RAB9A (0.65) LMNAMAPT
SCHEMBL6057945 0.81 LCK (0.56) LCK
SCHEMBL7626000 0.78 NPC1 (0.62) LCKLMNAMAPT
SCHEMBL6058329 0.78 LCK (0.54) LCK
SCHEMBL6057832 0.78 LCK (0.79) LCKFYNSRC
SCHEMBL7456062 0.76 GFER (0.62) TP53LMNAMAPT
SCHEMBL6058160 0.76 LCK (0.82) LCKTP53LMNAMAPT
SCHEMBL7258260 0.74 RAB9A (0.54) TP53LMNAMAPT
SCHEMBL3053748 0.74 PIK3CA (0.51) LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1037632-B1 BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2006-01-11 EP claimed