SCHEMBL4369759

SCHEMBL4369759

NCc1ccc(Oc2ccc(F)c(F)c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ST14 Q9Y5Y6 3/20 0.64
▸ SOS1 Q07889 1/20 0.54
▸ MAOB P27338 9/20 0.46
▸ LOXL2 Q9Y4K0 1/20 0.45
▸ SLC1A3 P43003 1/20 0.43
▸ SLC1A2 P43004 1/20 0.43
▸ SLC1A1 P43005 1/20 0.43
▸ AOC3 Q16853 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
SCHEMBL923443 0.84 ST14 (0.58) ST14SOS1MAOBLOXL2
SCHEMBL4380034 0.84 ST14 (0.58) ST14SOS1MAOBLOXL2
SCHEMBL14662168 0.82 ROCK2 (0.55) ST14SOS1MAOBAOC3
SCHEMBL4369986 0.81 ST14 (0.55) ST14MAOBLOXL2
SCHEMBL4209153 0.81 ST14 (0.85) ST14MAOBLOXL2
SCHEMBL6159854 0.81 SOS1 (0.50) ST14SOS1MAOBSLC1A3SLC1A2
SCHEMBL5125208 0.81 LTA4H (0.57) ST14SOS1MAOBSLC1A3SLC1A2
SCHEMBL12967364 0.81 SOS1 (0.50) ST14SOS1MAOBSLC1A3SLC1A2
SCHEMBL919783 0.79 LOXL2 (0.73) ST14SOS1MAOBLOXL2
SCHEMBL506288 0.79 ST14 (0.62) ST14MAOBLOXL2

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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