SCHEMBL19931746

SCHEMBL19931746

Cc1cc(NC(=O)[C@H](CCN2CCCCC2)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)CCC(=O)c2ccccc2)ccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CXCR3 P49682 11/20 0.45
▸ TP53 P04637 1/20 0.41
▸ PREP P48147 1/20 0.40
▸ FNTA P49354 1/20 0.39
▸ FNTB P49356 1/20 0.39
▸ CFTR P13569 2/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ GAA P10253 1/20 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
SCHEMBL19931754 0.99 CXCR3 (0.45) CXCR3TP53PREPFNTAFNTB
SCHEMBL19927159 0.93 CXCR3 (0.44) CXCR3TP53PREPFNTAFNTB
SCHEMBL19927161 0.93 CXCR3 (0.44) CXCR3TP53PREPFNTAFNTB
SCHEMBL26440006 0.93 CXCR3 (0.44) CXCR3TP53FNTAFNTBCFTR
SCHEMBL30376930 0.93 CXCR3 (0.44) CXCR3TP53PREPFNTAFNTB
SCHEMBL19927220 0.93 CXCR3 (0.44) CXCR3TP53FNTAFNTBCFTR
SCHEMBL19931971 0.93 CXCR3 (0.45) CXCR3TP53FNTAFNTBHTR1A
SCHEMBL19927221 0.93 CXCR3 (0.44) CXCR3TP53FNTAFNTBCFTR
SCHEMBL19927209 0.93 CXCR3 (0.44) CXCR3TP53FNTAFNTBCFTR
SCHEMBL19927211 0.93 CXCR3 (0.44) CXCR3TP53FNTAFNTBCFTR

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
EP-3507275-B1 CXCR3 RECEPTOR AGONISTS RECEPTOS LLC (US) 2023-04-26 — — EP disclosed
US-11040954-B1 CXCR3 receptor agonists RECEPTOS LLC (US) 2021-06-22 — — US disclosed
US-20190345133-A1 CXCR3 RECEPTOR AGONISTS RECEPTOS LLC 2019-11-14 — — US disclosed
WO-2018045246-A1 CXCR3 RECEPTOR AGONISTS CELGENE INTERNATIONAL II SARL (CH) 2018-03-08 — — 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-11040954-B1 CXCR3 receptor agonists CXCR3, CXCR1, CCR7 CXCR3 1/4885TP53 1874/4885PREP 4205/4885
US-20190345133-A1 CXCR3 RECEPTOR AGONISTS CXCR3, CXCR1, CCR7 CXCR3 1/4885TP53 1874/4885PREP 4205/4885

“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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