SCHEMBL2273105

SCHEMBL2273105

CSC(=NN1CC(O)CC(c2ccc(F)cc2Cl)C1=O)NC1CCN(C(=O)O)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 4/20 0.38
HPGD P15428 1/20 0.33
EPHX2 P34913 3/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
PROKR1 Q8TCW9 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
SIGMAR1 Q99720 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GRM5 P41594 1/20 0.31

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
SCHEMBL2273102 1.00 OPRL1 (0.38) OPRL1HPGDEPHX2KMT2AMEN1
SCHEMBL2273096 1.00 OPRL1 (0.38) OPRL1HPGDEPHX2KMT2AMEN1
SCHEMBL2272932 0.89 IDO1 (0.39) OPRL1EPHX2LMNAALDH1A1
SCHEMBL2272928 0.89 IDO1 (0.39) OPRL1EPHX2LMNAALDH1A1
SCHEMBL2272930 0.89 IDO1 (0.39) OPRL1EPHX2LMNAALDH1A1
SCHEMBL2275642 0.78 OPRL1 (0.39) OPRL1HPGDEPHX2KMT2AMEN1
SCHEMBL2275637 0.78 OPRL1 (0.39) OPRL1HPGDEPHX2KMT2AMEN1
SCHEMBL2272589 0.69 OPRL1 (0.39) OPRL1EPHX2KMT2AMEN1PROKR1
SCHEMBL2274559 0.69 HPGDS (0.39) OPRL1EPHX2KMT2AMEN1LMNA
SCHEMBL2274562 0.69 HPGDS (0.39) OPRL1EPHX2KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536710-B1 PIPERIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2016-07-13 EP disclosed
US-8486967-B2 Heteroaryl substituted piperidines HOFFMANN-LA ROCHE INC. (US) 2013-07-16 US disclosed
US-20110201605-A1 HETEROARYL SUBSTITUTED PIPERIDINES HOFFMANN-LA ROCHE, INC. 2011-08-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110201605-A1 HETEROARYL SUBSTITUTED PIPERIDINES APP, HPGDS, PSEN1 OPRL1 520/4885HPGD 170/4885EPHX2 438/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.