SCHEMBL8303664

SCHEMBL8303664

[CH2]c1cccc(C=Cc2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 15/20 0.55
CYSLTR2 Q9NS75 10/20 0.55
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 1/20 0.47
PKM P14618 1/20 0.47
RAB9A P51151 1/20 0.47
ABCC1 P33527 4/20 0.46
ABCC2 Q92887 3/20 0.46
MEN1 O00255 1/20 0.46
ABCC3 O15438 1/20 0.46
ABCC4 O15439 1/20 0.46
ABCC5 O15440 1/20 0.46
SLCO2B1 O94956 1/20 0.46
ABCB11 O95342 1/20 0.46
KMT2A Q03164 1/20 0.46
SLCO1B3 Q9NPD5 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
SLCO1B1 Q9Y6L6 1/20 0.46

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
SCHEMBL8303662 1.00 CYSLTR1 (0.55) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL13513030 0.91 CYSLTR1 (0.59) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL6750524 0.84 KDM4E (0.67) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL9757052 0.84 CYSLTR1 (0.72) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL6990449 0.84 CYSLTR1 (0.54) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL8783716 0.84 CYSLTR1 (0.54) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL8746348 0.84 CYSLTR1 (0.54) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL919524 0.84 CYSLTR1 (0.57) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL9757059 0.84 CYSLTR1 (0.72) CYSLTR1CYSLTR2KDM4ENPC1LMNA
SCHEMBL919522 0.84 CYSLTR1 (0.57) CYSLTR1CYSLTR2KDM4ENPC1LMNA

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-0469833-B1 N-Benzyl-Indoles, processes for their preparation and pharmaceutical compositions containing them LILLY CO ELI (GB) 1999-09-08 EP disclosed
EP-0658554-A1 N-benzyl dihydroindole LTD4 antagonists ELI LILLY AND COMPANY (US) 1995-06-21 EP disclosed
EP-0469833-A1 N-Benzyl-Indoles, processes for their preparation and pharmaceutical compositions containing them LILLY INDUSTRIES LIMITED (GB) 1992-02-05 EP disclosed