SCHEMBL9874486

SCHEMBL9874486

CC(=O)c1c(NC(=O)c2ccc(C)cc2)cccc1C(F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.56
ALDH1A1 P00352 3/20 0.56
ALOX12 P18054 2/20 0.56
LMNA P02545 1/20 0.56
PLK1 P53350 1/20 0.54
PLK3 Q9H4B4 1/20 0.54
RXFP1 Q9HBX9 2/20 0.51
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
TRPV1 Q8NER1 1/20 0.49
NPSR1 Q6W5P4 2/20 0.49
MEN1 O00255 1/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
GAA P10253 1/20 0.48
PARP1 P09874 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PTGS1 P23219 1/20 0.45

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
SCHEMBL9875019 0.89 MEN1 (0.56) MAPTALDH1A1ALOX12LMNAPLK1
SCHEMBL9872839 0.88 RAB9A (0.59) MAPTLMNAPLK1PLK3RXFP1
SCHEMBL9874407 0.86 F10 (0.59) MAPTALDH1A1LMNAPLK1PLK3
SCHEMBL28634418 0.84 ALDH1A1 (0.75) MAPTALDH1A1ALOX12LMNARXFP1
SCHEMBL9873952 0.84 NPC1 (0.54) MAPTALDH1A1LMNAPLK1PLK3
SCHEMBL9875470 0.84 ALDH1A1 (0.48) MAPTALDH1A1ALOX12LMNAPLK1
SCHEMBL9872671 0.82 SMN1; SMN2 (0.49) MAPTLMNAPLK1PLK3RAB9A
SCHEMBL9872356 0.77 SMN1; SMN2 (0.52) ALDH1A1LMNARXFP1TRPV1NPSR1
SCHEMBL9874730 0.77 CETP (0.46) LMNAPLK1PLK3MEN1KMT2A
SCHEMBL9874363 0.77 ALDH1A1 (0.57) MAPTALDH1A1LMNAPLK1RAB9A

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-5017576-A Antianxiolytic, hypnotic, anticonvulsant, antiepileptic RHONE-POULENC SANTE (FR) 1991-05-21 US disclosed