SCHEMBL9711591

SCHEMBL9711591

O=C1CC(c2ccccc2)NC(=O)C1C(=O)c1ccc(F)cc1C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
AR P10275 2/20 0.37
SMO Q99835 4/20 0.35
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
AURKA O14965 1/20 0.33
CHEK2 O96017 1/20 0.33
CSF1R P07333 1/20 0.33
RET P07949 1/20 0.33
FLT4 P35916 1/20 0.33
ABL2 P42684 1/20 0.33
BLK P51451 1/20 0.33
LIMK1 P53667 1/20 0.33
AURKB Q96GD4 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
LDHA P00338 1/20 0.33
P2RX7 Q99572 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
SCHEMBL9711752 0.89 CES2 (0.43) MAPT
SCHEMBL9711749 0.88 LMNA (0.38) MAPT
SCHEMBL9711547 0.84 LDHA (0.41) KMT2ALDHAP2RX7
SCHEMBL9711657 0.80 MRGPRX4 (0.42) MAPTKMT2ALDHA
SCHEMBL9711500 0.79 HSD11B1 (0.41) MAPTATMLDHA
SCHEMBL9711629 0.79 ALDH1A1 (0.38) KMT2ALDHA
SCHEMBL9711658 0.78 HSD11B1 (0.40) HCRTR1HCRTR2LDHA
SCHEMBL9711506 0.76 HPD (0.61) MAPTKMT2AFLT4
SCHEMBL9711548 0.76 HDAC11 (0.43)
SCHEMBL9711648 0.76 CES2 (0.43) MAPTKMT2A

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-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed