SCHEMBL8713186

SCHEMBL8713186

CCCCc1cccc2c1C(C(=O)N(CC(F)(F)F)N1CCC(NC(=O)Oc3ccccc3)CC1)c1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ CKS1B P61024 1/20 0.34
▸ SKP1 P63208 1/20 0.34
▸ SKP2 Q13309 1/20 0.34
▸ CCR8 P51685 2/20 0.33
▸ FAAH O00519 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL8664874 0.96 DRD2 (0.33) DRD2ALDH1A1RAB9AMCHR1CKS1B
SCHEMBL8485545 0.89 NPSR1 (0.40) MCHR1MEN1KMT2A
SCHEMBL8717987 0.88 CCR3 (0.44) DRD2CCR8MEN1KMT2A
SCHEMBL8484461 0.86 NPSR1 (0.39) MCHR1MEN1KMT2A
SCHEMBL8712541 0.86 CCR3 (0.44) DRD2CCR8MEN1KMT2A
SCHEMBL8712883 0.84 CCR3 (0.35) DRD2
SCHEMBL8665883 0.84 NPSR1 (0.37) DRD2MCHR1MEN1KMT2A
SCHEMBL8665520 0.84 CCR3 (0.42) DRD2
SCHEMBL8648481 0.83 CCR3 (0.39) DRD2ALDH1A1MCHR1
SCHEMBL8666099 0.82 NPSR1 (0.36) DRD2MCHR1MEN1KMT2A

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-5739135-A PREVENTING OR TREATING ATHEROSCLEROSIS, PANCREATITIS SECONDARY TO HYPERTRIGLYCERIDEMIA, HYPERGLYCEMIA, OBESITY BRISTOL-MYERS SQUIBB COMPANY (US) 1998-04-14 — — US disclosed
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