SCHEMBL10697896

SCHEMBL10697896

NC(=O)C(=Cc1ccccc1)OC(F)(F)C(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.41
AKR1C3 P42330 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
S1PR4 O95977 1/20 0.35
LMNA P02545 1/20 0.35
S1PR1 P21453 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
AKR1C1 Q04828 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
FBP1 P09467 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
HTT P42858 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 2/20 0.33
NPC1 O15118 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL7149422 0.83 MCL1 (0.46) MCL1AKR1C3ALDH1A1AKR1C1MEN1
SCHEMBL7149424 0.83 MCL1 (0.46) MCL1AKR1C3ALDH1A1AKR1C1MEN1
SCHEMBL7672337 0.73 ABCG2 (0.51) MCL1AKR1C3ALDH1A1AKR1C1MEN1
SCHEMBL20596721 0.72 MCL1 (0.45) MCL1AKR1C3ALDH1A1MAPTLMNA
SCHEMBL10436436 0.71 MCL1 (0.47) MCL1AKR1C3ALDH1A1MAPTAKR1C1
SCHEMBL5488316 0.70 MCL1 (0.46) MCL1AKR1C3ALDH1A1MAPTLMNA
SCHEMBL4649011 0.69 AKR1C3 (0.47) MCL1AKR1C3ALDH1A1MAPTLMNA
SCHEMBL4649014 0.69 AKR1C3 (0.47) MCL1AKR1C3ALDH1A1MAPTLMNA
SCHEMBL6510379 0.69 MCL1 (0.49) MCL1AKR1C3ALDH1A1AKR1C1MEN1
SCHEMBL7564827 0.69 MCL1 (0.49) MCL1AKR1C3ALDH1A1AKR1C1MEN1

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-0274546-A1 New oxazolinone compounds useful as intermediates for the preparation of insecticidal and acaracidal cinnamide compounds AMERICAN CYANAMID COMPANY (US) 1988-07-20 EP disclosed