SCHEMBL8665216

SCHEMBL8665216

CCCCc1c(F)ccc2c1C(C(=O)N(CC(F)(F)F)N1CCC(NC(=O)c3ccccc3)C1)c1cc(F)ccc1-2

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCR3 P51677 9/20 0.39
▸ MCHR1 Q99705 4/20 0.39
▸ DRD2 P14416 3/20 0.36
▸ DRD4 P21917 3/20 0.36
▸ SLC6A12 P48065 1/20 0.35
▸ TMEM97 Q5BJF2 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.34
▸ CHRM1 P11229 2/20 0.34

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
SCHEMBL8500946 0.94 CCR3 (0.36) CCR3MCHR1DRD2DRD4SLC6A12
SCHEMBL8668038 0.84 CCR3 (0.41) CCR3MCHR1DRD2DRD4SLC6A12
SCHEMBL8666049 0.83 L3MBTL1 (0.34) —
SCHEMBL8665883 0.83 NPSR1 (0.37) CCR3MCHR1DRD2DRD4NPSR1
SCHEMBL8484436 0.81 L3MBTL1 (0.37) —
SCHEMBL8666099 0.81 NPSR1 (0.36) CCR3MCHR1DRD2DRD4NPSR1
SCHEMBL8483744 0.80 CCR3 (0.44) CCR3MCHR1SLC6A12TMEM97SIGMAR1
SCHEMBL8665212 0.79 CCR3 (0.39) CCR3MCHR1DRD2DRD4SLC6A12
SCHEMBL8479389 0.79 DPP4 (0.38) MCHR1NPSR1
SCHEMBL8485545 0.78 NPSR1 (0.40) CCR3MCHR1SLC6A12TMEM97SIGMAR1

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-5827875-A PYRROLIDINE DERIVATIVES; ANTIATHEROSCLEROSIS AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-10-27 — — US disclosed
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