SCHEMBL8786282

SCHEMBL8786282

COc1c(OCC(F)(F)C(F)(F)F)ccnc1OC(=O)NC(=O)CN

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
AAK1 Q2M2I8 3/20 0.31

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
SCHEMBL8786684 0.91 CYP1A2 (0.39) CARM1CYP1A2CYP2C9AAK1
SCHEMBL8779207 0.86 CARM1 (0.31) CARM1
SCHEMBL8785737 0.85 SMN1; SMN2 (0.37) CARM1CYP1A2CYP2C9
SCHEMBL8785593 0.82 MAOB (0.41)
SCHEMBL8785157 0.81 FAAH (0.38) CYP1A2CYP2C9
SCHEMBL8785043 0.80 NPBWR1 (0.41) CARM1
SCHEMBL8785926 0.80 KMT2A (0.40) CYP1A2CYP2C9
SCHEMBL8786169 0.80 LMNA (0.40) CYP1A2CYP2C9
SCHEMBL8779408 0.80 CARM1 (0.30) CARM1
SCHEMBL8787115 0.77 TAS1R3 (0.35) CARM1

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-0650961-B1 Substituted heterocyclic carboxylic acid amides, their preparation, and their use as medicaments HOECHST AG (DE) 1997-03-05 EP disclosed
EP-0650961-A1 Substituted heterocyclic carboxylic acid amides, their preparation, and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1995-05-03 EP disclosed