SCHEMBL2651627

SCHEMBL2651627

COC(=O)C(=O)Nc1ccccc1C(CC1CCCC1)C(=O)Nc1nccs1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 14/20 0.56
▸ FFAR2 O15552 1/20 0.52
▸ KCNH2 Q12809 1/20 0.51
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ EPHX2 P34913 1/20 0.45
▸ POLB P06746 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
SCHEMBL2649782 0.83 GCK (0.68) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL4676850 0.82 GCK (0.59) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2664673 0.79 GCK (0.74) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2645294 0.78 GCK (0.59) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2647391 0.77 GCK (0.62) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2645222 0.77 GCK (0.73) GCKFFAR2KCNH2EPHX2
SCHEMBL2646466 0.76 GCK (0.72) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL4676853 0.76 GCK (0.58) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2658630 0.76 GCK (0.63) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2645352 0.76 GCK (0.63) GCKFFAR2KCNH2CYP1A2CYP3A4

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
EP-1283830-A1 PARA-AMINE SUBSTITUTED PHENYLAMIDE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-19 — — EP claimed
WO-2001085707-A1 PARA-AMINE SUBSTITUTED PHENYLAMIDE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-15 — — WO claimed
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