SCHEMBL19577415

SCHEMBL19577415

O=C(COc1ccc(Cl)c(F)c1)NC1CC2(C(=O)NCc3ccc(OC(F)F)cc3)CC1C2

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 18/20 0.45
▸ PTGES O14684 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL19577455 0.93 ATF4 (0.43) ATF4PTGESHTT
SCHEMBL24323366 0.93 ATF4 (0.43) ATF4PTGESHTT
SCHEMBL24323479 0.92 ATF4 (0.44) ATF4
SCHEMBL24322972 0.92 ATF4 (0.44) ATF4
SCHEMBL24323279 0.90 ATF4 (0.47) ATF4SMN1; SMN2
SCHEMBL24323038 0.89 ATF4 (0.48) ATF4
SCHEMBL24323329 0.89 ATF4 (0.46) ATF4
SCHEMBL24324152 0.88 ATF4 (0.45) ATF4
SCHEMBL24323037 0.88 ATF4 (0.45) ATF4LMNA
SCHEMBL24324501 0.88 ATF4 (0.42) ATF4SMN1; SMN2

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-2017193041-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES (US) 2017-11-09 — — WO disclosed
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