SCHEMBL6911078

SCHEMBL6911078

Oc1ccccc1C1(O)CCN(Cc2ccccc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.71
POLB P06746 1/20 0.69
CCR3 P51677 1/20 0.63
CYP3A4 P08684 3/20 0.56
HSD17B10 Q99714 1/20 0.56
SIGMAR1 Q99720 10/20 0.55
TSHR P16473 3/20 0.55
CYP2C19 P33261 3/20 0.55
TP53 P04637 2/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2D6 P10635 2/20 0.55
ALDH1A1 P00352 2/20 0.55
CYP2C9 P11712 2/20 0.55
DRD2 P14416 1/20 0.52
NFKB1 P19838 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52
MAPK1 P28482 1/20 0.52
HTR2B P41595 1/20 0.52
MTOR P42345 1/20 0.52

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
SCHEMBL10916463 0.86 OPRL1 (0.70) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL2883677 0.86 OPRL1 (0.66) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL6042326 0.86 OPRL1 (0.66) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL11195174 0.84 OPRL1 (0.77) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL2877688 0.84 OPRL1 (0.77) OPRL1POLBCCR3CYP3A4HSD17B10
Hydrochloric Acid SCHEMBL11256637 0.84 POLB (0.66) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL6709096 0.83 OPRL1 (0.63) OPRL1POLBCCR3CYP3A4HSD17B10
Hydrochloric Acid SCHEMBL11193622 0.83 OPRL1 (0.75) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL1411499 0.83 OPRL1 (1.00) OPRL1POLBCCR3CYP3A4HSD17B10
SCHEMBL23780161 0.82 OPRL1 (0.61) OPRL1POLBCCR3CYP3A4HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488028-B1 SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME (US) 2020-08-19 EP disclosed
US-20140336222-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME (US) 2014-11-13 US disclosed
US-20140336222-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME (US) 2014-11-13 US disclosed
US-8859776-B2 Substituted piperidines that increase p53 activity and the uses thereof MERCK SHARP & DOHME CORP. (US) 2014-10-14 US disclosed
US-8859776-B2 Substituted piperidines that increase p53 activity and the uses thereof MERCK SHARP & DOHME CORP. (US) 2014-10-14 US disclosed
US-20120208844-A1 SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME LLC 2012-08-16 US disclosed
US-20120208844-A1 SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY AND THE USES THEREOF MERCK SHARP & DOHME LLC 2012-08-16 US disclosed
WO-2011046771-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF SCHERING CORPORATION (US) 2011-04-21 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-20140336222-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF TP53, TP53BP1, MDM2 OPRL1 4407/4885POLB 1507/4885CCR3 4195/4885
US-20120208844-A1 SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY AND THE USES THEREOF TP53, MDM2, TP53BP1 OPRL1 4597/4885POLB 1230/4885CCR3 4210/4885

“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.