SCHEMBL3905147

SCHEMBL3905147

C=CCOc1ccc([C@H]2[C@H](O)CN(C(=O)O)C[C@@H]2OCc2ccc3c(c2)N(CCCOC)CCO3)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
REN P00797 5/20 0.35
GAA P10253 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GRM5 P41594 1/20 0.32
PIK3CD O00329 3/20 0.31
PIK3CA P42336 3/20 0.31
EGFR P00533 1/20 0.31
HTR2A P28223 1/20 0.30
RORC P51449 2/20 0.30

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
SCHEMBL3907424 0.93 REN (0.38) RENGRM5PIK3CDPIK3CARORC
SCHEMBL3907496 0.93 REN (0.38) RENGRM5PIK3CDPIK3CARORC
SCHEMBL3914348 0.93 REN (0.38) RENGRM5PIK3CDPIK3CARORC
SCHEMBL3906198 0.92 REN (0.37) RENGRM5PIK3CDPIK3CAEGFR
SCHEMBL3915055 0.92 REN (0.37) RENGAAHSD17B10RXFP1KDM4E
SCHEMBL3912028 0.92 REN (0.38) RENRXFP1GRM5PIK3CDPIK3CA
SCHEMBL3902981 0.91 REN (0.34) RENGAAHSD17B10RXFP1KDM4E
SCHEMBL3902983 0.91 REN (0.34) RENGAAHSD17B10RXFP1KDM4E
SCHEMBL1039229 0.91 REN (0.38) RENALDH1A1PIK3CDPIK3CA
SCHEMBL3906120 0.90 REN (0.34) RENGAAHSD17B10RXFP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090029981-A1 SUBSTITUTED 4-PHENYLPIPERIDINES NOVARTIS AG (CH) 2009-01-29 US disclosed
EP-2018862-A1 Substituted piperidines as therapeutic compounds Speedel Experimenta AG (CH) 2009-01-28 EP disclosed
EP-1973903-A1 SUBSTITUTED 4-PHENYLPIPERIDINES Speedel Experimenta AG (CH) 2008-10-01 EP disclosed
WO-2007082907-A1 SUBSTITUTED 4-PHENYLPIPERIDINES SPEEDEL EXPERIMENTA AG (CH) 2007-07-26 WO 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-20090029981-A1 SUBSTITUTED 4-PHENYLPIPERIDINES REN, AGTR2, ACE REN 1/4885GAA 505/4885HSD17B10 3330/4885

“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.