SCHEMBL11097485

SCHEMBL11097485

CN(C)C(=O)Nc1cccc(Oc2ccc(C(F)(F)F)cc2Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.62
STK39 Q9UEW8 1/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
FFAR1 O14842 2/20 0.49
RXFP1 Q9HBX9 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EGFR P00533 1/20 0.47
ERBB2 P04626 1/20 0.47
BRAF P15056 1/20 0.46
KDR P35968 1/20 0.46
MAPK14 Q16539 1/20 0.46
TNNI3K Q59H18 1/20 0.46

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
SCHEMBL11584161 0.91 STK39 (0.64) TP53STK39EGFRERBB2BRAF
SCHEMBL11096253 0.90 STK39 (0.51) TP53STK39MEN1KMT2AFFAR1
SCHEMBL11097831 0.89 STK39 (0.50) TP53STK39MEN1KMT2AFFAR1
SCHEMBL11581276 0.89 FFAR1 (0.56) TP53STK39MEN1KMT2AFFAR1
SCHEMBL11093171 0.88 STK39 (0.51) TP53STK39MEN1KMT2AFFAR1
SCHEMBL11127515 0.88 STK39 (0.48) TP53STK39MEN1KMT2AFFAR1
SCHEMBL11099693 0.85 STK39 (0.54) STK39MEN1KMT2ACYP1A2CYP3A4
SCHEMBL11572993 0.85 TP53 (0.77) TP53MEN1KMT2ARXFP1BRAF
SCHEMBL11097283 0.83 MAPT (0.58) TP53MEN1KMT2ANPSR1
Acifluorfen SCHEMBL7579211 0.82 TDP1 (0.72) TP53STK39MEN1KMT2AFFAR1

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
EP-0027965-B1 SUBSTITUTED UREAS, THEIR PREPARATION AND USE AS HERBICIDES, AND COMPOSITIONS THEREFOR BASF Aktiengesellschaft (DE) 1984-06-13 EP claimed