SCHEMBL11683333

SCHEMBL11683333

CN(O)C(=O)Nc1ccc(OC(F)(F)C(F)Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
TRPV1 Q8NER1 2/20 0.47
EPHX2 P34913 2/20 0.45
GAA P10253 1/20 0.44
ALDH1A1 P00352 4/20 0.41
FAAH O00519 1/20 0.40
ATM Q13315 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL11686263 0.90 TSHR (0.51) LMNAPOLBTRPV1EPHX2TSHR
SCHEMBL9687321 0.82 LMNA (0.54) LMNAPOLBTRPV1EPHX2ALDH1A1
SCHEMBL11000662 0.82 EPHX2 (0.67) LMNAPOLBTRPV1EPHX2ALDH1A1
SCHEMBL11684069 0.81 LMNA (0.52) LMNAPOLBTRPV1EPHX2ALDH1A1
SCHEMBL11682241 0.80 TSHR (0.53) TRPV1EPHX2TSHR
SCHEMBL11684086 0.80 EPHX2 (0.55) LMNAPOLBTRPV1EPHX2ALDH1A1
SCHEMBL10671063 0.80 TRPV1 (0.58) TRPV1EPHX2ALDH1A1TSHR
SCHEMBL11681677 0.78 EPHX2 (0.57) LMNAPOLBTRPV1EPHX2ALDH1A1
SCHEMBL11686688 0.78 EPHX2 (0.53) LMNAPOLBTRPV1EPHX2ALDH1A1
SCHEMBL10592956 0.77 ALDH1A1 (0.49) LMNAPOLBTRPV1EPHX2ALDH1A1

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
US-4013452-A Urea derivatives and their use as herbicides HOECHST AKTIENGESELLSCHAFT (DT) 1977-03-22 US disclosed
US-3937726-A UREA DERIVATIVES AND THEIR USE AS HERBICIDES HOECHST AKTIENGESELLSCHAFT (DT) 1976-02-10 US disclosed