SCHEMBL9300710

SCHEMBL9300710

CC(C)N(C(=O)COc1nc2cccc(F)c2s1)c1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ALDH1A1 P00352 2/20 0.38
ATM Q13315 1/20 0.38
MC4R P32245 4/20 0.37
MC1R Q01726 4/20 0.37
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
CCKAR P32238 2/20 0.34
CCKBR P32239 2/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ACACB O00763 6/20 0.34
GRM1 Q13255 1/20 0.33
NAAA Q02083 1/20 0.33

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
SCHEMBL28752919 0.85 KMT2A (0.60) MEN1KMT2AALDH1A1PTGS1PTGS2
SCHEMBL9302343 0.81 MEN1 (0.47) MEN1KMT2AALDH1A1MC4RMC1R
SCHEMBL9264877 0.78 MEN1 (0.69) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL9300799 0.77 MEN1 (0.55) MEN1KMT2AALDH1A1ATMMC4R
SCHEMBL14769814 0.76 KMT2A (0.38) MEN1KMT2AALDH1A1ATMMC4R
SCHEMBL10830843 0.76 KMT2A (0.72) MEN1KMT2AALDH1A1PTGS1PTGS2
SCHEMBL9301532 0.76 MEN1 (0.40) MEN1KMT2AALDH1A1PTGS1PTGS2
SCHEMBL9877499 0.74 KMT2A (0.36) MEN1KMT2AALDH1A1ATMMC4R
Flufenacet SCHEMBL116467 0.73 MLYCD (0.34) MEN1KMT2AALDH1A1ATMMC4R
Flufenacet SCHEMBL4897219 0.73 MLYCD (0.34) MEN1KMT2AALDH1A1ATMMC4R

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-5356864-A New herbicidal fluorobenzothiazolyloxyacetamides BAYER AKTIENGESELLSCHAFT (DE) 1994-10-18 US claimed