SCHEMBL4170568

SCHEMBL4170568

COC(=O)c1ccc(OCC(=O)O)cc1.O=C(COc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADIPOR2 Q86V24 1/20 0.58
ADIPOR1 Q96A54 1/20 0.58
USP2 O75604 1/20 0.57
MCHR1 Q99705 4/20 0.56
POLB P06746 1/20 0.56
SIGMAR1 Q99720 4/20 0.55
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
UTS2R Q9UKP6 1/20 0.53
CCR3 P51677 2/20 0.49
HRH1 P35367 1/20 0.49
KCNH2 Q12809 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
CCR1 P32246 1/20 0.48

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
SCHEMBL4170598 0.92 ADIPOR2 (0.67) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL2210339 0.86 ADIPOR2 (0.63) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL17951031 0.86 MCHR1 (0.68) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL4161579 0.85 SIGMAR1 (0.70) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL24514572 0.84 ADIPOR2 (0.81) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL17950944 0.84 USP2 (0.77) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL17950923 0.84 ADIPOR2 (0.63) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL17950896 0.84 POLB (0.63) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL17950986 0.84 POLB (0.63) ADIPOR2ADIPOR1USP2MCHR1POLB
SCHEMBL4036078 0.84 POLB (0.65) ADIPOR2ADIPOR1USP2MCHR1POLB

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
US-20090197914-A1 Piperidine Derivatives, Their Process for Preparation, Their Use as Therapeutic Agents and Pharmaceutical Compositions Containing Them ASTRAZENECA AB (SE) 2009-08-06 US disclosed
EP-1994003-A1 PIPERIDINE DERIVATIVES, THEIR PROCESS FOR PREPARATION, THEIR USE AS THERAPEUTIC AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM . AstraZeneca AB (SE) 2008-11-26 EP disclosed
WO-2007102768-A1 PIPERIDINE DERIVATIVES, THEIR PROCESS FOR PREPARATION, THEIR USE AS THERAPEUTIC AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM . ASTRAZENECA AB (SE) 2007-09-13 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-20090197914-A1 Piperidine Derivatives, Their Process for Preparation, Their Use as Therapeutic Agents and Pharmaceutical Compositions Containing Them CCR3, CCR1, CCR4 ADIPOR2 1677/4885ADIPOR1 938/4885USP2 3716/4885

“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.