SCHEMBL8308465

SCHEMBL8308465

CC(NC(=O)Nc1ccc(C(F)(F)F)cc1)C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.62
KIF11 P52732 1/20 0.54
KDM4E B2RXH2 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 2/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
FPR2 P25090 5/20 0.52
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
BAZ1A Q9NRL2 1/20 0.48
MTOR P42345 1/20 0.48

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
SCHEMBL12377252 0.84 EPHX2 (0.70) EPHX2KIF11MEN1KMT2AMAPT
SCHEMBL19549502 0.82 FPR2 (0.66) EPHX2MEN1KMT2ACA12CA1
SCHEMBL29687050 0.81 EPHX2 (0.65) EPHX2MAPTFPR2RAB9A
SCHEMBL29687180 0.81 KIF11 (0.51) KIF11KDM4EMAPTCA12CA1
SCHEMBL29687222 0.81 KIF11 (0.51) KIF11KDM4EMAPTCA12CA1
SCHEMBL29687159 0.80 MDM2 (0.58) KDM4ESMN1; SMN2MEN1KMT2AHTT
SCHEMBL29687046 0.80 KIF11 (0.58) EPHX2KIF11SMN1; SMN2MEN1KMT2A
SCHEMBL6873113 0.79 HSD17B10 (0.62) EPHX2KDM4ESMN1; SMN2KMT2AMAPT
SCHEMBL1903330 0.79 HSD17B10 (0.62) EPHX2KDM4ESMN1; SMN2KMT2AMAPT
SCHEMBL28729179 0.78 EPHX2 (1.00) EPHX2KIF11MEN1KMT2AMAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920424-A1 NON-PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1999-06-09 EP claimed
WO-1998007718-A1 NON-PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-02-26 WO claimed
EP-3265083-B1 SUBSTITUTED UREA DEPSIPEPTIDE ANALOGS AS ACTIVATORS OF THE CLPP ENDOPEPTIDASE ST JUDE CHILDRENS RES HOSPITAL (US) 2022-07-06 EP disclosed
EP-0920424-A1 NON-PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1999-06-09 EP disclosed
WO-1998007718-A1 NON-PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-02-26 WO disclosed