SCHEMBL3140141

SCHEMBL3140141

COc1cc(OCc2ccc(C(=O)O)cc2)c(N(Cc2ccccn2)S(=O)(=O)c2nc(C)cs2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.41
TAS2R14 Q9NYV8 1/20 0.41
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
RAF1 P04049 3/20 0.38
MAP2K1 Q02750 3/20 0.38
MAPT P10636 2/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 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
SCHEMBL3144808 0.94 RXRA (0.41) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL3148767 0.90 TRPM8 (0.43) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL3144068 0.87 TRPM8 (0.42) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL3140585 0.86 TRPM8 (0.48) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL3138616 0.84 TRPM8 (0.35) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL3136448 0.80 RXRA (0.46) RXRATAS2R14RXRBRXRGKDM4E
SCHEMBL214741 0.78 NR1H4 (0.43) RXRATAS2R14RXRBRXRG
SCHEMBL3148806 0.78 ALDH1A1 (0.46) RXRARXRBRXRGKDM4EALDH1A1
SCHEMBL216100 0.77 NR1H4 (0.45) RXRARXRBRXRGTRPM8
SCHEMBL12361898 0.77 RXRA (0.39) RXRARXRBRXRGTRPM8

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-9181187-B2 Therapeutic agent for urinary excretion disorder ONO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 US disclosed
EP-2123273-B1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER ONO PHARMACEUTICAL CO (JP) 2013-10-23 EP disclosed
US-20100076038-A1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER ONO PHARMACEUTICAL CO., LTD. (JP) 2010-03-25 US disclosed
EP-2123273-A1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER ONO Pharmaceutical Co., Ltd. (JP) 2009-11-25 EP 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-20100076038-A1 THERAPEUTIC AGENT FOR URINARY EXCRETION DISORDER PTGER1, TMPRSS15, EPDR1 RXRA 4540/4885TAS2R14 1774/4885RXRB 4498/4885

“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.