SCHEMBL8651966

SCHEMBL8651966

CCCCc1c(N2CCC(NC(=O)c3cc(Cl)ccc3C)CC2)ccc2c1C(C(=O)NCC(F)(F)F)c1ccccc1-2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A12 P48065 1/20 0.36
▸ POLB P06746 2/20 0.36
▸ DRD3 P35462 3/20 0.35
▸ DRD2 P14416 2/20 0.35
▸ DRD4 P21917 2/20 0.35
▸ CNR1 P21554 3/20 0.35
▸ CNR2 P34972 3/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.34
▸ MTTP P55157 2/20 0.34
▸ CHRM2 P08172 1/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ CHRM1 P11229 1/20 0.34
▸ DRD1 P21728 1/20 0.34
▸ TBXA2R P21731 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ ADRA1A P35348 1/20 0.34
▸ OPRM1 P35372 1/20 0.34
▸ SLC6A3 Q01959 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
SCHEMBL8654366 0.92 KMT2A (0.40) DRD3DRD2DRD4ADRA2ASLC6A2
SCHEMBL8648478 0.89 CCNE1 (0.37) POLBDRD3CNR1MTTPCHRM2
SCHEMBL8717984 0.85 CCR3 (0.42) SLC6A12POLBDRD3DRD2NPSR1
SCHEMBL8712539 0.83 CCR3 (0.42) SLC6A12POLBDRD3DRD2MTTP
SCHEMBL8665881 0.83 DRD2 (0.37) POLBDRD3DRD2DRD4NPSR1
SCHEMBL8713182 0.83 CKS1B (0.38) POLBDRD3DRD2DRD4CNR1
SCHEMBL8593680 0.82 POLB (0.42) POLBDRD3DRD2DRD4NPSR1
SCHEMBL8665519 0.81 CCR3 (0.40) DRD2
SCHEMBL8666097 0.81 DRD2 (0.36) POLBDRD3DRD2DRD4NPSR1
SCHEMBL8712881 0.80 POLB (0.35) POLBDRD3DRD2DRD4

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-5712279-A Inhibitors of microsomal triglyceride transfer protein and method BRISTOL-MYERS SQUIBB COMPANY (US) 1998-01-27 — — US disclosed
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