SCHEMBL2275499

SCHEMBL2275499

NN1CC(O)CC(c2ccc(F)cc2Cl)C1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
SLC6A4 P31645 1/20 0.41
HTR2B P41595 1/20 0.41
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
ACHE P22303 1/20 0.34
P2RX7 Q99572 2/20 0.33
NR3C2 P08235 2/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
OPRL1 P41146 4/20 0.33
PROKR1 Q8TCW9 1/20 0.33
SCN9A Q15858 1/20 0.33
PIK3CD O00329 1/20 0.33
HPGD P15428 1/20 0.33
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
GRM5 P41594 1/20 0.32

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
SCHEMBL17907545 1.00 HTR2A (0.41) HTR2AHTR2CSLC6A4HTR2BMAOA
SCHEMBL2275505 1.00 HTR2A (0.41) HTR2AHTR2CSLC6A4HTR2BMAOA
SCHEMBL2271765 0.79 P2RX7 (0.35) HTR2AHTR2CSLC6A4HTR2BP2RX7
SCHEMBL2271757 0.79 P2RX7 (0.35) HTR2AHTR2CSLC6A4HTR2BP2RX7
SCHEMBL2276166 0.77 OPRL1 (0.36) HTR2AHTR2CSLC6A4HTR2BACHE
SCHEMBL2276165 0.77 OPRL1 (0.36) HTR2AHTR2CSLC6A4HTR2BACHE
SCHEMBL909037 0.76 HTR2A (0.40) HTR2AHTR2CSLC6A4HTR2BACHE
SCHEMBL195461 0.69 HTR2C (0.40) HTR2AHTR2CHTR2B
SCHEMBL2275637 0.69 OPRL1 (0.39) OPRL1HPGDGRM5
SCHEMBL505182 0.64 OPRL1 (0.49) HTR2AHTR2CSLC6A4HTR2BOPRL1

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-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
EP-2536710-A2 PIPERIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2012-12-26 EP disclosed
WO-2011101304-A2 PIPERIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2011-08-25 WO 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 HTR2A 5/4885HTR2C 131/4885SLC6A4 1549/4885

“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.