SCHEMBL20140659

SCHEMBL20140659

COC(=O)c1cc(CC2CCNCC2)c(C)cc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAT P00750 1/20 0.40
CHEK1 O14757 2/20 0.39
CHEK2 O96017 2/20 0.39
HTR4 Q13639 3/20 0.38
PDGFRB P09619 1/20 0.38
FGFR1 P11362 1/20 0.38
PDGFRA P16234 1/20 0.38
FLT1 P17948 1/20 0.38
FGFR3 P22607 1/20 0.38
KDR P35968 1/20 0.38
DVL1 O14640 1/20 0.37
DVL3 Q92997 1/20 0.37
MAPT P10636 1/20 0.36
CHRM1 P11229 2/20 0.36
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM3 P20309 1/20 0.35
MEN1 O00255 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL18432591 0.82 PDGFRB (0.43) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL20140680 0.80 P2RX7 (0.46) PLATCHEK1CHEK2HTR4DVL1
SCHEMBL20142115 0.76 EED (0.48) MAPTKMT2AALDH1A1GNRHR
SCHEMBL17594623 0.75 KDM4E (0.40) HTR4MAPTCHRM1CHRM2CHRM4
SCHEMBL12489156 0.73 PDGFRB (0.40) HTR4PDGFRBFGFR1PDGFRAFLT1
SCHEMBL19564552 0.73 EED (0.38) PLATCHEK1CHEK2HTR4CHRM1
SCHEMBL20139847 0.73 PDGFRB (0.47) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL20139884 0.72 BDKRB1 (0.47) CHRM4CYP2D6ALDH1A1
SCHEMBL4247366 0.71 GBA1 (0.51) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL20140904 0.71 PDGFRB (0.46) PDGFRBFGFR1PDGFRAFLT1FGFR3

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
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed
WO-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed