SCHEMBL10341372

SCHEMBL10341372

COc1ccc2c([c]c(C)n2C(=O)C=Cc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ ATM Q13315 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ ABCG2 Q9UNQ0 1/20 0.47
▸ MAOB P27338 3/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HSPD1 P10809 1/20 0.46
▸ TNFRSF1A P19438 1/20 0.46
▸ HSPE1 P61604 1/20 0.46
▸ CYP1B1 Q16678 1/20 0.46
▸ MMP1 P03956 2/20 0.44
▸ MMP2 P08253 2/20 0.44
▸ MMP9 P14780 2/20 0.44

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
SCHEMBL10341371 1.00 MAPT (0.47) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL11205822 0.80 AKR1C3 (0.53) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL8354130 0.79 LMNA (0.54) MAPTRAB9AMEN1KMT2ALMNA
SCHEMBL11409731 0.78 ALOX5 (0.52) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL8354821 0.74 RAB9A (0.47) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL13879185 0.74 ALOX5 (0.48) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL2739302 0.74 ALOX5 (0.48) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL8354825 0.74 AKR1C3 (0.51) MAPTRAB9AMEN1KMT2ALMNA
SCHEMBL9815440 0.73 LMNA (0.53) MAPTRAB9AMEN1KMT2ALMNA
SCHEMBL9815439 0.73 LMNA (0.53) MAPTRAB9AMEN1KMT2ALMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0195582-B1 5-AMINOSALICYLIC ACID DERIVATIVES OF NON-STEROIDAL ANTIINFLAMMATORY ACIDS SMITH KLINE DAUELSBERG GmbH (DE) 1990-01-24 — — EP disclosed
US-4851443-A NON-STEROIDAL ANTIINFLAMMATORY; DERIVATIVES OF 5-AMINOSALICYLIC ACID SMITH KLINE DAUELSBERG, GMBH (DE) 1989-07-25 — — US disclosed
US-4783487-A N-(1-carboxy-2-hydroxy-5-phenyl)-2-(6-methoxy-2-naphthyl)propionamide and anti-inflammatory use thereof SMITH KLINE DAUELSBERG GMBH (DE) 1988-11-08 — — US disclosed
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