SCHEMBL921762

SCHEMBL921762

NCc1ccc(Oc2ccccc2Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.64
ST14 Q9Y5Y6 1/20 0.52
LPAR1 Q92633 5/20 0.46
LPAR5 Q9H1C0 5/20 0.46
XIAP P98170 1/20 0.46
MAPK14 Q16539 1/20 0.45
MAOB P27338 5/20 0.44
KCNH2 Q12809 1/20 0.43
SCN5A Q14524 1/20 0.43
SCN9A Q15858 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43

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
Hydrochloric Acid SCHEMBL2787535 0.98 DPP4 (0.62) DPP4ST14LPAR1LPAR5XIAP
SCHEMBL12239010 0.87 DPP4 (0.57) DPP4ST14MAOBCARM1PRMT6
SCHEMBL921481 0.84 DPP4 (0.58) DPP4MAOB
SCHEMBL7176453 0.84 DPP4 (0.53) DPP4LPAR1LPAR5XIAPMAPK14
SCHEMBL11419701 0.81 LPAR1 (0.52) DPP4LPAR1LPAR5XIAPMAPK14
SCHEMBL27689483 0.81 LPAR1 (0.49) DPP4LPAR1LPAR5XIAPMAPK14
SCHEMBL10773230 0.81 LTA4H (0.60) DPP4LPAR1LPAR5XIAPMAPK14
SCHEMBL4367987 0.80 ST14 (0.50) DPP4ST14MAOBKCNH2SCN9A
SCHEMBL17241842 0.79 DPP4 (0.56) DPP4ST14
SCHEMBL10121244 0.79 ST14 (0.53) DPP4ST14MAOBKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 DPP4 1270/4885ST14 708/4885LPAR1 4369/4885

“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.