SCHEMBL9871765

SCHEMBL9871765

O=C(Nc1cccc(C(F)(F)F)c1)C(Cl)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
CYP1A2 P05177 1/20 0.67
POLB P06746 1/20 0.67
CYP3A4 P08684 1/20 0.67
CYP2C9 P11712 1/20 0.67
MAPT P10636 6/20 0.62
HTT P42858 2/20 0.62
RAB9A P51151 1/20 0.62
TACR1 P25103 1/20 0.58
LMNA P02545 4/20 0.57
S1PR3 Q99500 2/20 0.57
HTR1E P28566 1/20 0.57
TP53 P04637 1/20 0.56
XBP1 P17861 1/20 0.56
KDR P35968 1/20 0.56
KDM4E B2RXH2 2/20 0.56
PCTP Q9UKL6 1/20 0.56

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
SCHEMBL9795561 0.89 NTRK1 (0.57) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL9795433 0.88 MEN1 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL9795519 0.88 MAPT (0.58) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL29521694 0.84 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL31202774 0.84 RAB9A (0.54) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL9338885 0.84 MAPT (0.62) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL6715643 0.83 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL6715648 0.83 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL9879487 0.83 MAPT (0.55) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL19638131 0.81 SMN1; SMN2 (0.60) ALDH1A1SMN1; SMN2MEN1KMT2ACYP1A2

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-5076832-A Certain 3-(substituted phenyl)-5-(substituted phenyl)-1-ethylimidazolidine-4-ones as herbicides ICI AMERICAS INC. (US) 1991-12-31 US disclosed