SCHEMBL3318233

SCHEMBL3318233

CC12CC3(C)CC(C)(C1)CC(C(=O)N[C@H]1CCCNC(=O)C1)(C2)C3

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.37
CCR2 P41597 5/20 0.36
RAB9A P51151 1/20 0.35
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.32
EPHX2 P34913 1/20 0.30
ALOX12 P18054 1/20 0.30
FKBP5 Q13451 1/20 0.30
CRBN Q96SW2 1/20 0.30

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
SCHEMBL3316845 0.89 ALOX15 (0.44) CCR2POLBSMN1; SMN2GAAEPHX2
SCHEMBL5172985 0.89 ALOX15 (0.44) CCR2POLBSMN1; SMN2GAAEPHX2
SCHEMBL1080974 0.81 CCR2 (0.58) HPGDCCR2TSHRALDH1A1GAA
SCHEMBL719799 0.81 CCR2 (0.58) CCR2RAB9APOLBALDH1A1SMN1; SMN2
SCHEMBL8312942 0.77 ALDH1A1 (0.42) CCR2ALDH1A1
SCHEMBL9162699 0.77 ALDH1A1 (0.42) CCR2ALDH1A1
SCHEMBL1065451 0.77 GAA (0.47) CCR2RAB9ATSHRPOLBALDH1A1
SCHEMBL1062408 0.76 CCR2 (0.41) HPGDCCR2TSHRPOLBALDH1A1
SCHEMBL1080106 0.76 CCR2 (0.41) HPGDCCR2TSHRPOLBALDH1A1
SCHEMBL2987304 0.76 GAA (0.46) CCR2RAB9APOLBALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497261-B2 3-aminocaprolactam compounds for treating inflammatory disorders CAMBRIDGE ENTERPRISE LIMITED (GB) 2013-07-30 US claimed
US-20100292213-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-11-18 US claimed
US-7691845-B2 Anti-inflammatory agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-04-06 US claimed
US-20080194541-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2008-08-14 US claimed
US-8497261-B2 3-aminocaprolactam compounds for treating inflammatory disorders CAMBRIDGE ENTERPRISE LIMITED (GB) 2013-07-30 US disclosed
EP-1781299-B1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTPR LTD (GB) 2010-12-22 EP disclosed
US-20100292213-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-11-18 US disclosed
US-7691845-B2 Anti-inflammatory agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-04-06 US disclosed
US-20080194541-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2008-08-14 US 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-20080194541-A1 Anti-Inflammatory Agents TNF, IL1RN, FPR1 HPGD 687/4885CCR2 96/4885RAB9A 2491/4885
US-20100292213-A1 Anti-Inflammatory Agents TNF, IL1RN, IL1R1 HPGD 617/4885CCR2 121/4885RAB9A 2291/4885

“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.