SCHEMBL7348683

SCHEMBL7348683

COc1c(F)cc(Cl)cc1CCl

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.37
CYP1A2 P05177 3/20 0.36
CYP2D6 P10635 2/20 0.36
MEN1 O00255 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP2C9 P11712 1/20 0.36
MAPT P10636 2/20 0.35
CYP2C19 P33261 1/20 0.34
GAA P10253 1/20 0.33
ALDH1A1 P00352 2/20 0.33
GFER P55789 1/20 0.33
LMNA P02545 1/20 0.32
ILK Q13418 1/20 0.32
PTGS2 P35354 1/20 0.31
PDCD1LG2 Q9BQ51 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
DBH P09172 1/20 0.30
TAAR1 Q96RJ0 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
SCHEMBL14612616 0.85 KMT2A (0.37) KMT2ACYP1A2CYP2D6MEN1SMN1; SMN2
SCHEMBL15054521 0.83 MAPT (0.43) KMT2ACYP1A2CYP2D6MEN1SMN1; SMN2
SCHEMBL1942011 0.82 ALDH1A1 (0.35) KMT2ACYP1A2MEN1MAPTGAA
SCHEMBL8467047 0.81 PDGFRB (0.37) MAPTILKPTGS2DBH
SCHEMBL4830230 0.80 GAA (0.54) KMT2ACYP1A2CYP2D6MEN1SMN1; SMN2
SCHEMBL19088270 0.75 KMT2A (0.41) KMT2ACYP1A2CYP2D6MEN1SMN1; SMN2
SCHEMBL19120435 0.74 SCN4A (0.38) SMN1; SMN2MAPTILKPTGS2
SCHEMBL31574688 0.72 MEP1B (0.39) CYP1A2SMN1; SMN2MAPTALDH1A1GFER
SCHEMBL15561614 0.72 CA2 (0.43) KMT2AMEN1SMN1; SMN2MAPTLMNA
SCHEMBL29582345 0.72 CA2 (0.43) KMT2AMEN1SMN1; SMN2MAPTLMNA

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-4207327-A N-(4-Pyrazolidinyl)benzamides and their amino precursors A. H. ROBINS COMPANY, INC. (US) 1980-06-10 US disclosed