SCHEMBL14325787

SCHEMBL14325787

Cc1ccc(NC(=O)CN(C)C(=O)c2cc(-c3csc(C)n3)cn2C)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ NPC1 O15118 4/20 0.50
▸ ALDH1A1 P00352 3/20 0.48
▸ MAPT P10636 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ GFER P55789 1/20 0.47
▸ KMT2A Q03164 3/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ POLB P06746 1/20 0.44
▸ PSMD14 O00487 1/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ DNMT1 P26358 1/20 0.43
▸ CASP6 P55212 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL16403987 0.93 RAB9A (0.50) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL14315443 0.82 RAB9A (0.63) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL16404071 0.82 RAB9A (0.40) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL16403920 0.82 ALDH1A1 (0.38) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL16404150 0.82 RAB9A (0.42) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL14224988 0.80 RAB9A (0.41) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL14224974 0.79 ALDH1A1 (0.39) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL14224958 0.78 ALDH1A1 (0.43) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL16403981 0.78 RAB9A (0.43) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT
SCHEMBL16404062 0.77 NPC1 (0.54) RAB9ASMN1; SMN2NPC1ALDH1A1MAPT

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
US-8937065-B2 Compositions and methods for modulating a kinase CLEVEXEL PHARMA (FR) 2015-01-20 — — US disclosed
WO-2012172438-A9 COMPOSITIONS AND METHODS FOR MODULATING A KINASE DYNAMIX PHARMACEUTICALS LTD. (IL) 2013-02-07 — — WO disclosed
WO-2012172438-A2 COMPOSITIONS AND METHODS FOR MODULATING A KINASE DYNAMIX PHARMACEUTICALS LTD. (IL) 2012-12-20 — — WO disclosed
Send feedback