SCHEMBL10980222

SCHEMBL10980222

CC(C(=O)OCC(=O)N1CCN(c2ccccc2)CC1)c1ccc(-c2ccccc2Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ LMNA P02545 2/20 0.48
▸ HTT P42858 1/20 0.47
▸ GRM5 P41594 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45

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
Bifeprofen SCHEMBL2109705 0.88 L3MBTL1 (0.44) ALDH1A1L3MBTL1HSD17B10NPC1RAB9A
Bifeprofen SCHEMBL10989641 0.87 NFE2L2 (0.45) ALDH1A1L3MBTL1HSD17B10NPC1RAB9A
SCHEMBL10983045 0.83 DPP4 (0.46) ALDH1A1MAPTL3MBTL1HTTNPC1
SCHEMBL11120650 0.82 GFER (0.57) ALDH1A1MAPTL3MBTL1LMNAGRM5
Hydrochloric Acid SCHEMBL10979991 0.81 GFER (0.56) ALDH1A1MAPTL3MBTL1LMNAGRM5
SCHEMBL10981141 0.72 PTGS2 (0.66) MAPTLMNA
SCHEMBL9230403 0.71 LMNA (0.57) ALDH1A1LMNAHTTNPC1RAB9A
SCHEMBL10983798 0.69 MAPT (0.57) ALDH1A1MAPTL3MBTL1LMNAGRM5
SCHEMBL23544874 0.69 MAPT (0.64) ALDH1A1MAPTL3MBTL1LMNAHTT
Hydrochloric Acid SCHEMBL10979890 0.69 MAPK1 (0.52) ALDH1A1MAPTLMNAHTTGRM5

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-4510142-A ANTIINFLAMMATORY OR ANALGESIC AGNET PIERRE FABRE S.A. (FR) 1985-04-09 — — US disclosed
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