SCHEMBL4812915

SCHEMBL4812915

Cc1cccc(C2(O)CCN(C(=O)CCl)CC2)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
HTT P42858 1/20 0.55
OPRD1 P41143 3/20 0.52
OPRK1 P41145 3/20 0.52
OPRM1 P35372 2/20 0.52
OPRL1 P41146 2/20 0.52
POLB P06746 1/20 0.45
CYP46A1 Q9Y6A2 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HDAC4 P56524 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
SOS1 Q07889 1/20 0.40
ADAMTS5 Q9UNA0 1/20 0.40
HSD11B1 P28845 1/20 0.40
EPHX2 P34913 1/20 0.40

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
SCHEMBL4815044 0.83 ALDH1A1 (0.67) ALDH1A1OPRD1OPRK1OPRM1OPRL1
SCHEMBL22055641 0.83 OPRM1 (0.57) ALDH1A1OPRD1OPRK1OPRM1OPRL1
SCHEMBL5373048 0.83 OPRM1 (0.60) ALDH1A1OPRD1OPRK1OPRM1OPRL1
SCHEMBL3139132 0.81 OPRL1 (0.61) OPRD1OPRK1OPRM1OPRL1MEN1
SCHEMBL4806928 0.78 ALDH1A1 (0.48) ALDH1A1OPRD1OPRK1OPRM1OPRL1
SCHEMBL7831565 0.76 GPR119 (0.54) ALDH1A1OPRD1OPRK1OPRM1OPRL1
SCHEMBL11561476 0.76 OPRD1 (0.62) ALDH1A1OPRD1OPRK1OPRM1OPRL1
SCHEMBL4819431 0.76 DRD2 (0.61) ALDH1A1OPRM1OPRL1MEN1KMT2A
SCHEMBL27352126 0.75 OPRM1 (0.59) OPRD1OPRK1OPRM1OPRL1HDAC4
SCHEMBL5912423 0.75 SMN1; SMN2 (0.54) ALDH1A1OPRD1OPRK1OPRM1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468368-B2 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof SANOFI AVENTIS (FR) 2008-12-23 US disclosed
US-7294628-B2 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-11-13 US disclosed
EP-1513835-B1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2006-08-16 EP disclosed
US-20060167007-A1 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2006-07-27 US disclosed
EP-1513836-B1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2006-05-03 EP disclosed
US-20050176722-A1 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2005-08-11 US disclosed
EP-1513835-A1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2005-03-16 EP disclosed
EP-1513836-A1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2005-03-16 EP disclosed
WO-2003104225-A1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2003-12-18 WO disclosed
WO-2003104226-A1 PIPERAZINYLACYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2003-12-18 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 (2 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-20060167007-A1 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof NR5A2, NR3C2, NR3C1 ALDH1A1 509/4885HTT 4047/4885OPRD1 71/4885
US-20050176722-A1 Piperazinylacylpiperidine derivatives, their preparation and therapeutic use thereof NR5A2, NR3C1, CBR1 ALDH1A1 445/4885HTT 4309/4885OPRD1 47/4885

“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.