SCHEMBL8665883

SCHEMBL8665883

CCCCc1cccc2c1C(C(=O)N(CC(F)(F)F)N1CCC(NC(=O)c3ccccc3)C1)c1ccccc1-2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.37
▸ DRD2 P14416 6/20 0.37
▸ DRD4 P21917 6/20 0.37
▸ UTS2R Q9UKP6 1/20 0.36
▸ CTSL P07711 1/20 0.35
▸ CTSB P07858 1/20 0.35
▸ CTSK P43235 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CHRM1 P11229 2/20 0.34
▸ CARM1 Q86X55 1/20 0.34
▸ PRMT6 Q96LA8 1/20 0.34
▸ MCHR1 Q99705 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CCR2 P41597 2/20 0.34
▸ CCR3 P51677 1/20 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
SCHEMBL8666099 0.98 NPSR1 (0.36) NPSR1DRD2DRD4UTS2RCTSL
SCHEMBL8485545 0.95 NPSR1 (0.40) NPSR1POLBCARM1PRMT6MCHR1
SCHEMBL8501239 0.94 NPSR1 (0.33) NPSR1DRD2DRD4UTS2RPOLB
SCHEMBL8484461 0.93 NPSR1 (0.39) NPSR1POLBCARM1PRMT6MCHR1
SCHEMBL8501052 0.92 NPSR1 (0.33) NPSR1DRD2DRD4POLBCHRM1
SCHEMBL8669690 0.91 UTS2R (0.39) NPSR1DRD2DRD4UTS2RCTSL
SCHEMBL8664874 0.89 DRD2 (0.33) DRD2UTS2RMCHR1MEN1KMT2A
SCHEMBL8665520 0.89 CCR3 (0.42) NPSR1DRD2CCR3
SCHEMBL8668038 0.88 CCR3 (0.41) NPSR1DRD2DRD4MCHR1CCR3
SCHEMBL8665531 0.87 CCR3 (0.41) NPSR1DRD2CCR3

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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