SCHEMBL20465984

SCHEMBL20465984

CC[S+]([O-])c1ccc(-n2cncn2)nc1-c1nc2cc(C(F)(F)F)nc(C#N)c2n1C

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL20468292 0.89 ALDH1A1 (0.32) ALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL24012218 0.88 ALDH1A1 (0.31) ALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL20465929 0.86 PDE10A (0.32) —
SCHEMBL20465925 0.86 SMN1; SMN2 (0.33) ALDH1A1HPGDSMN1; SMN2
SCHEMBL20468293 0.84 ALDH1A1 (0.31) ALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL20465982 0.83 EIF4EBP1 (0.32) —
SCHEMBL20468526 0.83 ALDH1A1 (0.32) ALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL24286101 0.82 ALOX5AP (0.30) —
SCHEMBL20465861 0.81 EIF4EBP1 (0.31) —
SCHEMBL20104434 0.78 — —

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
EP-3577114-B1 METHOD FOR THE PREPARATION OF HALOGENATED IMIDAZOPYRIDINE DERIVATIVES BAYER AG (DE) 2021-11-10 — — EP disclosed
WO-2018141954-A1 ARYL OR HETEROARYL-SUBSTITUTED IMIDAZO PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2018-08-09 — — WO disclosed
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