SCHEMBL8651963

SCHEMBL8651963

CCCCN(CC(F)(F)F)C(=O)C1c2ccccc2-c2cccc(N3CCC(NC(=O)c4cc(Cl)ccc4C)CC3)c21

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.40
▸ CNR2 P34972 2/20 0.40
▸ SLC6A12 P48065 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ DRD4 P21917 3/20 0.34
▸ HTR7 P34969 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ CRHR1 P34998 2/20 0.33
▸ AVPR2 P30518 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL8654362 0.91 MEN1 (0.40) CNR1CNR2DRD4KMT2ADRD2
SCHEMBL8648475 0.88 CCR3 (0.39) CNR1CNR2HTR7DRD2CCNE1
SCHEMBL8485533 0.87 NPSR1 (0.42) CNR1CNR2SLC6A12KMT2ADRD2
SCHEMBL8655291 0.86 CNR1 (0.38) CNR1CNR2DRD4KMT2ADRD2
SCHEMBL8717983 0.85 CCR3 (0.43) CNR1CNR2SLC6A12HTR7KMT2A
SCHEMBL8484454 0.85 NPSR1 (0.42) CNR1CNR2SLC6A12KMT2ADRD2
SCHEMBL8650772 0.84 CYP46A1 (0.39) CNR1CNR2POLBHTR7DRD2
SCHEMBL8712537 0.83 CCR3 (0.43) CNR1CNR2SLC6A12HTR7KMT2A
SCHEMBL8713180 0.82 CKS1B (0.41) CNR1CNR2DRD2
SCHEMBL8665880 0.82 UTS2R (0.39) DRD4DRD2NPSR1

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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