SCHEMBL1080108

SCHEMBL1080108

CC1(C(=O)N[C@H]2CCCCNC2=O)CCCCC1O

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.70
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.45
MMP1 P03956 1/20 0.45
MMP3 P08254 1/20 0.45

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
SCHEMBL1062410 1.00 CCR2 (0.70) CCR2RAB9ANPC1MMP1MMP3
SCHEMBL12061252 0.83 CCR2 (0.97) CCR2RAB9ANPC1
SCHEMBL242474 0.82 CCR2 (1.00) CCR2RAB9ANPC1
SCHEMBL13006180 0.82 CCR2 (1.00) CCR2RAB9ANPC1
SCHEMBL12061277 0.82 CCR2 (1.00) CCR2RAB9ANPC1
SCHEMBL12061309 0.78 CCR2 (0.82) CCR2RAB9A
SCHEMBL1081727 0.78 CCR2 (0.92) CCR2RAB9ANPC1
SCHEMBL1080106 0.77 CCR2 (0.41) CCR2
SCHEMBL1062408 0.77 CCR2 (0.41) CCR2
SCHEMBL12061265 0.76 CCR2 (0.55) CCR2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1896036-B1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTPR LTD (GB) 2013-01-23 EP disclosed
US-8076323-B2 Anti-inflammatory agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-12-13 US disclosed
US-20110003792-A1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-01-06 US disclosed
US-7803794-B2 Anti-inflammatory agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-09-28 US disclosed
US-20100016286-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-01-21 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-20100016286-A1 Anti-Inflammatory Agents TNF, LTC4S, IL6 CCR2 54/4885RAB9A 3745/4885NPC1 3112/4885
US-20110003792-A1 ANTI-INFLAMMATORY AGENTS TNF, LTC4S, PTGS1 CCR2 45/4885RAB9A 4003/4885NPC1 2704/4885

“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.