SCHEMBL9136759

SCHEMBL9136759

O=C(F)c1c(F)nc(Cl)nc1Cl

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 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
SCHEMBL9139159 0.89 ALDH1A1 (0.33) ALDH1A1LMNA
SCHEMBL9135606 0.86 ALDH1A1 (0.35) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2
SCHEMBL9136650 0.83 KEAP1 (0.31) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2
SCHEMBL9137791 0.75 KEAP1 (0.33) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2
SCHEMBL9414543 0.69 KEAP1 (0.32) KEAP1NFE2L2
SCHEMBL4082477 0.69 ALDH1A1 (0.39) ALDH1A1MAPK1SMN1; SMN2LMNA
SCHEMBL1989330 0.69 ALDH1A1 (0.50) KEAP1NFE2L2ALDH1A1MAPK1SMN1; SMN2
SCHEMBL9139057 0.69
SCHEMBL7749289 0.67 SMN1; SMN2 (0.39) ALDH1A1MAPK1SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL10581422 0.67 ALDH1A1 (0.48) KEAP1NFE2L2ALDH1A1MAPK1SMN1; 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
US-5399674-A Dyestuffs containing pyrimidine-carboxylic acid amide radical having fiber-reactive group, processes for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1995-03-21 US disclosed