SCHEMBL28159117

SCHEMBL28159117

OCC=Cc1cccc(C=Cc2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR1 Q9Y271 13/20 0.54
▸ CYSLTR2 Q9NS75 10/20 0.54
▸ ABCC1 P33527 4/20 0.48
▸ ABCC2 Q92887 3/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ ABCC3 O15438 1/20 0.48
▸ ABCC4 O15439 1/20 0.48
▸ ABCC5 O15440 1/20 0.48
▸ SLCO2B1 O94956 1/20 0.48
▸ ABCB11 O95342 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ SLCO1B3 Q9NPD5 1/20 0.48
▸ ABCG2 Q9UNQ0 1/20 0.48
▸ SLCO1B1 Q9Y6L6 1/20 0.48

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
SCHEMBL626120 1.00 CYSLTR1 (0.54) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL5818062 0.91 CYSLTR1 (0.47) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL28557590 0.91 CYSLTR1 (0.47) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL13513030 0.89 CYSLTR1 (0.59) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL8136569 0.84 CYSLTR1 (0.54) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL8136565 0.84 CYSLTR1 (0.54) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL29517086 0.83 MEN1 (0.48) CYSLTR1CYSLTR2MEN1KMT2A
SCHEMBL919522 0.82 CYSLTR1 (0.57) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL9757059 0.82 CYSLTR1 (0.72) CYSLTR1CYSLTR2ABCC1ABCC2MEN1
SCHEMBL5819160 0.82 CYSLTR1 (0.57) CYSLTR1CYSLTR2ABCC1ABCC2MEN1

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
CN-106928136-B A kind of method of graphene palladium cobalt sequential catalyst synthesis montestron sodium intermediate 济南大学 2019-05-10 — — CN disclosed
CN-106928136-A A kind of Graphene palladium cobalt sequential catalyst synthesizes the method for MK intermediate 济南大学 2017-07-07 — — CN disclosed
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