SCHEMBL11800029

SCHEMBL11800029

Clc1ccc2oc(-c3ccc(C=Cc4nc5ccccc5s4)cc3)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.48
▸ MAPT P10636 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ INSR P06213 2/20 0.48
▸ APP P05067 2/20 0.48
▸ NCOA1 Q15788 1/20 0.48
▸ ALOX5 P09917 1/20 0.46
▸ EPHX2 P34913 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ GAA P10253 1/20 0.42

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
SCHEMBL11800021 1.00 MEN1 (0.48) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL11804481 0.80 MAOB (0.51) KMT2ARAB9ASMN1; SMN2APPNPC1
SCHEMBL11804485 0.80 MAOB (0.51) KMT2ARAB9ASMN1; SMN2APPNPC1
SCHEMBL11805814 0.79 APP (0.52) MAPTKMT2ARAB9AAPPNPC1
SCHEMBL11805806 0.79 APP (0.52) MAPTKMT2ARAB9AAPPNPC1
SCHEMBL18851120 0.79 MEN1 (0.67) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL11803358 0.76 APP (0.43) MEN1KMT2ARAB9ASMN1; SMN2APP
SCHEMBL11803351 0.76 APP (0.43) MEN1KMT2ARAB9ASMN1; SMN2APP
SCHEMBL319386 0.75 MEN1 (0.77) MEN1MAPTKMT2ARAB9ASMN1; SMN2
SCHEMBL319385 0.75 MEN1 (0.77) MEN1MAPTKMT2ARAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3993645-A Stilbene optical brighteners and compositions brightened therewith STERLING DRUG INC. (US) 1976-11-23 — — US disclosed
US-3932301-A NYLON, POLYESTERS STERLING DRUG INC. (US) 1976-01-13 — — US disclosed
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