SCHEMBL4797185

SCHEMBL4797185

CCC1=C(c2cc(Cl)cc(Cl)c2)C(=O)N2C[C@H](O)CC12Cc1ccc(Br)cc1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 20/20 0.38
ITGB2 P05107 19/20 0.38
ICAM1 P05362 19/20 0.38

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
SCHEMBL4849625 1.00 ITGAL (0.38) ITGALITGB2ICAM1
SCHEMBL4849619 1.00 ITGAL (0.38) ITGALITGB2ICAM1
SCHEMBL4797065 0.88 TRPV4 (0.35) ITGALITGB2ICAM1
SCHEMBL4638373 0.87 ITGAL (0.36) ITGALITGB2ICAM1
SCHEMBL4638112 0.87 ITGAL (0.36) ITGALITGB2ICAM1
SCHEMBL4799102 0.82 GAA (0.33) ITGALITGB2ICAM1
SCHEMBL5946599 0.82 GAA (0.33) ITGALITGB2ICAM1
SCHEMBL5946602 0.82 GAA (0.33) ITGALITGB2ICAM1
SCHEMBL4799107 0.82 GAA (0.33) ITGALITGB2ICAM1
SCHEMBL4797207 0.81 ITGAL (0.39) ITGALITGB2ICAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7375237-B2 Pyrrolizine compounds useful as anti-inflammatory agents BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-20 US claimed
US-20060052434-A1 Pyrrolizine compounds useful as anti-inflammatory agents CEREP S.A. (FR) 2006-03-09 US claimed
US-7375237-B2 Pyrrolizine compounds useful as anti-inflammatory agents BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-20 US disclosed
US-20060052434-A1 Pyrrolizine compounds useful as anti-inflammatory agents CEREP S.A. (FR) 2006-03-09 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 (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-20060052434-A1 Pyrrolizine compounds useful as anti-inflammatory agents NFKBIA, TNF, NFKB1 ITGAL 4577/4885ITGB2 4816/4885ICAM1 492/4885

“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.