SCHEMBL7224599

SCHEMBL7224599

COCC(=O)NCC(=O)Nc1cc(Cl)ccc1OCC(=O)N1C[C@H](C)N(Cc2ccc(F)cc2)C[C@H]1C

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 20/20 0.72
FPR3 P25089 1/20 0.58
GPR65 Q8IYL9 1/20 0.58
GPR35 Q9HC97 1/20 0.58

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
SCHEMBL4587897 0.94 CCR1 (0.74) CCR1FPR3GPR65GPR35
SCHEMBL4587901 0.94 CCR1 (0.74) CCR1FPR3GPR65GPR35
SCHEMBL4587907 0.94 CCR1 (0.74) CCR1FPR3GPR65GPR35
SCHEMBL4588285 0.91 CCR1 (0.75) CCR1FPR3GPR65GPR35
SCHEMBL4588280 0.91 CCR1 (0.75) CCR1FPR3GPR65GPR35
SCHEMBL4588542 0.89 CCR1 (0.75) CCR1FPR3GPR65GPR35
SCHEMBL4588547 0.89 CCR1 (0.75) CCR1FPR3GPR65GPR35
SCHEMBL4588545 0.89 CCR1 (0.75) CCR1FPR3GPR65GPR35
SCHEMBL7218079 0.88 CCR1 (0.70) CCR1FPR3GPR65GPR35
SCHEMBL4589664 0.88 CCR1 (0.74) CCR1FPR3GPR65GPR35

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
US-6573266-B1 Compounds used for treating multitiple sclerosis and encephalomyelitis SCHERING AKTIENGESELLSCHAFT (DE) 2003-06-03 US disclosed