SCHEMBL4380034

SCHEMBL4380034

Cc1cc(Oc2ccc(CN)cc2)ccc1F

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ST14 Q9Y5Y6 3/20 0.58
▸ SLC6A4 P31645 2/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ MAOB P27338 6/20 0.42
▸ LOXL2 Q9Y4K0 1/20 0.41
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ CHEK2 O96017 1/20 0.40
▸ SOS1 Q07889 1/20 0.39

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
SCHEMBL4351558 0.84 HTR2A (0.44) ST14SLC6A4HTR2AKCNH2CHEK2
SCHEMBL921340 0.84 ST14 (0.64) ST14SLC6A4HTR2AMAOB
SCHEMBL4369759 0.84 ST14 (0.64) ST14MAOBLOXL2SOS1
SCHEMBL14667748 0.83 LTA4H (0.52) ST14SLC6A4HTR2AKCNH2CHEK2
SCHEMBL1372208 0.80 ALDH1A1 (0.57) SLC6A4HTR2AKCNH2MAOBCHEK2
SCHEMBL18210774 0.80 TEAD4 (0.48) SLC6A4HTR2AKCNH2CHEK2SOS1
SCHEMBL15832064 0.79 ST14 (0.58) ST14SLC6A4HTR2AKCNH2MAOB
SCHEMBL923443 0.79 ST14 (0.58) ST14SLC6A4HTR2AKCNH2MAOB
SCHEMBL52174 0.79 SLC6A2 (0.51) SLC6A4HTR2ALOXL2SLC6A2SLC6A3
SCHEMBL29817987 0.79 SLC6A2 (0.51) SLC6A4HTR2ALOXL2SLC6A2SLC6A3

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
WO-2009117421-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2009-09-24 — — WO disclosed
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