SCHEMBL9486992

SCHEMBL9486992

CCOC(=O)CN(C(=O)Cc1cccc(C(F)(F)F)c1)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.49
SERPINE1 P05121 1/20 0.46
ALDH1A1 P00352 2/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.42
MLYCD O95822 1/20 0.42
THRB P10828 1/20 0.41
OPRK1 P41145 1/20 0.41
ICMT O60725 1/20 0.41
NR4A2 P43354 2/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
HDAC6 Q9UBN7 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PDK1 Q15118 1/20 0.41
MAOB P27338 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40

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
SCHEMBL9483650 0.95 MAPK14 (0.45) MAPK14SERPINE1ALDH1A1HTTMEN1
SCHEMBL9484793 0.92 HTT (0.49) SERPINE1ALDH1A1HTTMEN1KMT2A
SCHEMBL9484182 0.91 MAPK14 (0.44) MAPK14ALDH1A1HTTMEN1KMT2A
SCHEMBL9484446 0.90 HDAC6 (0.47) SERPINE1ALDH1A1HTTMEN1KMT2A
SCHEMBL9483626 0.89 MEN1 (0.53) MAPK14MEN1KMT2AMLYCDPPARG
SCHEMBL9483393 0.89 THRB (0.45) SERPINE1ALDH1A1HTTMEN1KMT2A
SCHEMBL9483952 0.88 TDP1 (0.47) SERPINE1ALDH1A1HTTMEN1KMT2A
SCHEMBL9484821 0.87 CCR1 (0.44) SERPINE1ALDH1A1HTTTHRBHDAC6
SCHEMBL9483312 0.86 THRB (0.47) ALDH1A1HTTMEN1KMT2AMAPT
SCHEMBL9483291 0.85 MAPK14 (0.43) MAPK14SERPINE1ALDH1A1HTTMEN1

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-5191089-A Herbicides for weeds that don't harm soybeans, corn, cotton or barley BAYER AKTIENGESELLSCHAFT (DE) 1993-03-02 US disclosed