SCHEMBL14430962

SCHEMBL14430962

COc1ccc(C)cc1Oc1ccc(N)c(C(=O)Nc2nc(C)cs2)c1

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 18/20 0.82
▸ KDM4E B2RXH2 2/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ MITF O75030 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ LMNA P02545 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ MAPK10 P53779 1/20 0.48

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
SCHEMBL2643117 0.90 GCK (1.00) GCKKDM4ESMN1; SMN2NPC1MITF
SCHEMBL2643373 0.88 GCK (0.64) GCKKDM4ENPC1RAB9ALMNA
SCHEMBL2643455 0.87 GCK (0.82) GCKKDM4ESMN1; SMN2NPC1MITF
SCHEMBL2643904 0.85 GCK (0.83) GCKKDM4ESMN1; SMN2NPC1MITF
SCHEMBL2643522 0.84 GCK (0.84) GCK
SCHEMBL2643912 0.82 GCK (0.84) GCK
SCHEMBL2642949 0.82 GCK (0.81) GCKKDM4ENPC1RAB9A
SCHEMBL2643973 0.81 GCK (0.80) GCKKDM4ENPC1RAB9A
SCHEMBL2642904 0.81 GCK (0.80) GCKKDM4ENPC1RAB9A
SCHEMBL2642942 0.81 GCK (0.82) GCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253188-B2 Aminobenzamide derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-07 — — US disclosed
US-7253188-B2 Aminobenzamide derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-07 — — US disclosed
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