SCHEMBL18087510

SCHEMBL18087510

COc1c(F)cc(C(=O)NC2(C(=O)O)Cc3ccccc3C2)cc1OCCc1cccc(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 6/20 0.60
▸ GPR132 Q9UNW8 1/20 0.42
▸ CXCR5 P32302 7/20 0.41
▸ F10 P00742 1/20 0.40
▸ ERAP1 Q9NZ08 1/20 0.39

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
SCHEMBL1561333 0.91 LPAR1 (0.68) LPAR1GPR132CXCR5
SCHEMBL1560963 0.91 LPAR1 (0.57) LPAR1GPR132CXCR5
SCHEMBL1561271 0.86 LPAR1 (0.73) LPAR1GPR132CXCR5
SCHEMBL1561378 0.84 LPAR1 (0.67) LPAR1GPR132CXCR5F10
SCHEMBL1560554 0.81 LPAR1 (0.60) LPAR1GPR132CXCR5F10ERAP1
SCHEMBL1560511 0.80 LPAR1 (0.60) LPAR1CXCR5
SCHEMBL1809260 0.80 LPAR1 (0.61) LPAR1GPR132
SCHEMBL1809808 0.80 LPAR1 (0.61) LPAR1GPR132
SCHEMBL18832667 0.79 LPAR1 (0.53) LPAR1GPR132F10
SCHEMBL1561628 0.79 LPAR1 (0.58) LPAR1CXCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160272577-A1 ACYLAMINO-SUBSTITUTED FUSED CYCLOPENTANECARBOXYLIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI SA (FR) 2016-09-22 — — 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-20160272577-A1 ACYLAMINO-SUBSTITUTED FUSED CYCLOPENTANECARBOXYLIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS EDF1, LPAR2, LIPG LPAR1 6/4885GPR132 539/4885CXCR5 438/4885

“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.

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