SCHEMBL3802103

SCHEMBL3802103

O=C1NCCCC1NC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.92

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 13/20 0.92
ALDH1A1 P00352 3/20 0.43
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.41
EPHX1 P07099 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
SCHEMBL12292042 1.00 CCR2 (0.92) CCR2ALDH1A1POLBRAB9AKDM4E
SCHEMBL195373 0.96 CCR2 (1.00) CCR2ALDH1A1RAB9AKDM4E
SCHEMBL13006178 0.96 CCR2 (1.00) CCR2ALDH1A1RAB9AKDM4E
SCHEMBL12292044 0.94 CCR2 (0.97) CCR2ALDH1A1RAB9AKDM4E
SCHEMBL12292046 0.91 CCR2 (0.81) CCR2ALDH1A1POLBEPHX1
SCHEMBL3259739 0.86 CCR2 (0.69) CCR2KDM4E
SCHEMBL2971927 0.86 CCR2 (0.69) CCR2ALDH1A1RAB9AKDM4E
SCHEMBL12799207 0.83 CCR2 (0.77) CCR2ALDH1A1RAB9AKDM4E
SCHEMBL13483782 0.83 CCR2 (0.77) CCR2ALDH1A1RAB9AKDM4E
SCHEMBL13013126 0.82 CCR2 (0.75) CCR2RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150141460-A1 Anti-inflammatory Compositions CAMBRIDGE ENTERPRISE LIMITED (GB) 2015-05-21 US disclosed
US-8853200-B2 Treatment of rheumatoid arthritis with 3-amino lactam compounds CAMBRIDGE ENTERPRISE LIMITED (GB) 2014-10-07 US disclosed
EP-2572716-A1 Anti-inflammatory Composition Cambridge Enterprise Limited (GB) 2013-03-27 EP disclosed
US-20100324089-A1 Anti-inflammatory composition CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-12-23 US disclosed
EP-2185151-A1 ANTI-INFLAMMATORY COMPOSITION Cambridge Enterprise Ltd. (GB) 2010-05-19 EP disclosed
WO-2009016390-A1 ANTI-INFLAMMATORY COMPOSITION CAMBRIDGE ENTERPRISE LIMITED (GB) 2009-02-05 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-20150141460-A1 Anti-inflammatory Compositions TNF, PTGES2, IL1B CCR2 94/4885ALDH1A1 668/4885POLB 3842/4885
US-20100324089-A1 Anti-inflammatory composition TNF, IL1B, IL1A CCR2 85/4885ALDH1A1 938/4885POLB 3158/4885

“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.