SCHEMBL4031641

SCHEMBL4031641

O=C(COc1ccc(-c2ccccc2)cc1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.70
SIGMAR1 Q99720 3/20 0.69
ADIPOR2 Q86V24 1/20 0.66
ADIPOR1 Q96A54 1/20 0.66
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
MCHR1 Q99705 7/20 0.63
USP2 O75604 1/20 0.62
FAAH O00519 1/20 0.60
BCHE P06276 1/20 0.60
ACHE P22303 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL25568937 0.92 POLB (0.66) POLBSIGMAR1ADIPOR2ADIPOR1MCHR1
SCHEMBL24514572 0.90 ADIPOR2 (0.81) POLBSIGMAR1ADIPOR2ADIPOR1MEN1
SCHEMBL4036078 0.90 POLB (0.65) POLBSIGMAR1ADIPOR2ADIPOR1MEN1
SCHEMBL24514563 0.90 POLB (0.86) POLBSIGMAR1ADIPOR2ADIPOR1MCHR1
SCHEMBL4161579 0.89 SIGMAR1 (0.70) POLBSIGMAR1ADIPOR2ADIPOR1MEN1
SCHEMBL4170598 0.89 ADIPOR2 (0.67) POLBSIGMAR1ADIPOR2ADIPOR1MEN1
SCHEMBL17950985 0.88 POLB (0.63) POLBSIGMAR1ADIPOR2ADIPOR1MEN1
SCHEMBL17950986 0.88 POLB (0.63) POLBSIGMAR1ADIPOR2ADIPOR1MEN1
SCHEMBL17950896 0.88 POLB (0.63) POLBSIGMAR1ADIPOR2ADIPOR1MEN1
SCHEMBL17951031 0.88 MCHR1 (0.68) POLBSIGMAR1ADIPOR2ADIPOR1MEN1

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
EP-1212299-B1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA UK LTD (GB) 2009-04-08 EP claimed
US-20230234923-A1 USING ADIPONECTIN RECEPTOR AGONISTS TO TREAT INFLAMMATION AND BONE DISEASES IN DIABETES TRUSTEES OF TUFTS COLLEGE 2023-07-27 US disclosed
US-11655212-B2 Using adiponectin receptor agonists to treat inflammation and bone diseases in diabetes TRUSTEES OF TUFTS COLLEGE (US) 2023-05-23 US disclosed
US-20220185777-A1 USING ADIPONECTIN RECEPTOR AGONISTS TO TREAT INFLAMMATION AND BONE DISEASES IN DIABETES TRUSTEES OF TUFTS COLLEGE 2022-06-16 US disclosed
EP-1212299-B1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA UK LTD (GB) 2009-04-08 EP disclosed
EP-1212299-B1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA UK LTD (GB) 2009-04-08 EP disclosed
US-20050250792-A1 Substituted piperidine compounds useful as modulators of chemokine receptor activity MERRILL LYNCH CAPITAL, A DIVISION OF MERRILL LYNCH BUSINESS FINANCIAL SERVICES, INC. AS ADMINISTRATIVE AGENT 2005-11-10 US disclosed
US-6903085-B1 Substituted piperidine compounds useful as modulators of chemokine receptor activity ASTRAZENECA, AB (CH) 2005-06-07 US disclosed
EP-1212299-A1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca UK Limited (GB) 2002-06-12 EP disclosed
WO-2001014333-A1 SUBSTITUTED PIPERIDINE COMPOUNDS USEFUL AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA UK LIMITED (GB) 2001-03-01 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 (4 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-11655212-B2 Using adiponectin receptor agonists to treat inflammation and bone diseases in diabetes ADIPOR1, ADIPOR2, GPR119 POLB 3985/4885SIGMAR1 3904/4885ADIPOR2 2/4885
US-20230234923-A1 USING ADIPONECTIN RECEPTOR AGONISTS TO TREAT INFLAMMATION AND BONE DISEASES IN DIABETES ADIPOR1, ADIPOR2, GPR119 POLB 3985/4885SIGMAR1 3904/4885ADIPOR2 2/4885
US-20220185777-A1 USING ADIPONECTIN RECEPTOR AGONISTS TO TREAT INFLAMMATION AND BONE DISEASES IN DIABETES ADIPOR1, ADIPOR2, GPR119 POLB 3985/4885SIGMAR1 3904/4885ADIPOR2 2/4885
US-20050250792-A1 Substituted piperidine compounds useful as modulators of chemokine receptor activity CXCR4, CXCR1, CXCR3 POLB 2244/4885SIGMAR1 126/4885ADIPOR2 607/4885

“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.