SCHEMBL20141040

SCHEMBL20141040

O=C(O)N1CCN(c2cccc(F)c2)[C@H](CO)C1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.43
ADAMTS5 Q9UNA0 12/20 0.43
MMP2 P08253 4/20 0.43
MMP14 P50281 3/20 0.42
MMP13 P45452 2/20 0.40
ENPP2 Q13822 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40
MGLL Q99685 1/20 0.39
BPTF Q12830 1/20 0.39

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
SCHEMBL20141301 0.85 MAPK1 (0.42) RORCADAMTS5MMP14LMNAMAPT
SCHEMBL20141063 0.84 RORC (0.42) RORCADAMTS5SMN1; SMN2LMNA
SCHEMBL21360345 0.83 TP53 (0.47) ADAMTS5MMP2LMNA
SCHEMBL23777576 0.82 ADAMTS5 (0.57) ADAMTS5MMP2MMP14MMP13SMN1; SMN2
SCHEMBL23777577 0.82 ADAMTS5 (0.57) ADAMTS5MMP2MMP14MMP13SMN1; SMN2
SCHEMBL20141224 0.77 KDM4E (0.46) SMN1; SMN2NPC1LMNAMAPTTSHR
SCHEMBL14921000 0.76 ADAMTS5 (0.47) ADAMTS5MMP2MMP14ENPP2SMN1; SMN2
SCHEMBL27690557 0.75 HTR2A (0.46) BPTF
SCHEMBL20141303 0.74 MAPK1 (0.43) ADAMTS5MMP2LMNAMAPT
SCHEMBL631955 0.73 SMN1; SMN2 (0.59) ADAMTS5MMP2ENPP2SMN1; SMN2NPC1

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
EP-3538091-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF Navitor Pharmaceuticals, Inc. (US) 2019-09-18 EP disclosed
WO-2018089499-A1 PHENYL AMINO PIPERIDINE mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed