SCHEMBL7991076

SCHEMBL7991076

CCC(=O)c1ccc(OCCCc2c[nH]cn2)cc1F

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.39
RARA P10276 1/20 0.38
RARB P10826 1/20 0.38
MAOB P27338 2/20 0.37
MAOA P21397 1/20 0.36

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
SCHEMBL4384663 0.88 MAOB (0.49) MAOBMAOA
SCHEMBL4385149 0.82 MAOB (0.34) CRBNRARARARBMAOBMAOA
SCHEMBL4385158 0.82 MAOB (0.34) CRBNRARARARBMAOBMAOA
SCHEMBL7977335 0.81 SMN1; SMN2 (0.51)
SCHEMBL4386278 0.80 HRH3 (0.35) MAOB
SCHEMBL4383633 0.79 KMT2A (0.45)
SCHEMBL4386375 0.78 HRH3 (0.42) MAOB
SCHEMBL4384666 0.74 LTA4H (0.33)
SCHEMBL4381007 0.74 SMN1; SMN2 (0.52)
SCHEMBL7987565 0.74 L3MBTL1 (0.55)

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-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US claimed