SCHEMBL6221992

SCHEMBL6221992

CSC(N)=NC(=O)c1cccc(F)c1CCc1cc(Cl)ccc1Br

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 15/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CNR1 P21554 1/20 0.31

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
SCHEMBL13147515 0.79 ALB (0.42) NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL6222542 0.78 MC4R (0.64) MC4RKCNH2
SCHEMBL3090277 0.78 MC4R (0.41) MC4RNPC1RAB9AHPGDSMN1; SMN2
SCHEMBL6222879 0.68 MC4R (0.54) MC4R
SCHEMBL3080665 0.68 MC4R (0.78) MC4R
SCHEMBL13723655 0.67 L3MBTL1 (0.37) MC4RL3MBTL1RAB9ASMN1; SMN2
SCHEMBL13724113 0.66 ALB (0.42) RAB9ASMN1; SMN2
SCHEMBL3082437 0.66 KDM4E (0.43) MC4RNPC1RAB9A
SCHEMBL2560634 0.63 NOS3 (0.44) HPGDSMN1; SMN2
SCHEMBL29960836 0.61 TAAR1 (0.52) HPGDSMN1; SMN2

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-1590338-A2 MODULATORS OF MELANOCORTIN RECEPTOR Gene Logic Inc. (US) 2005-11-02 — — EP disclosed
WO-2004050610-A2 MODULATORS OF MELANOCORTIN RECEPTOR GENE LOGIC INC. (US) 2004-06-17 — — WO disclosed
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