SCHEMBL19313488

SCHEMBL19313488

COc1ccc2ccc3c(c2c1)CCC(c1ccccc1Cl)O3

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 15/20 0.65
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MTNR1A P48039 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
SCHEMBL19538256 0.88 DPP4 (0.64) DPP4MTNR1A
SCHEMBL19313388 0.86 DPP4 (0.65) DPP4KDM4EALDH1A1GAAMAPT
SCHEMBL19313413 0.81 DPP4 (0.63) DPP4
SCHEMBL24101376 0.81 DPP4 (0.63) DPP4
SCHEMBL19313474 0.81 DPP4 (0.63) DPP4
SCHEMBL19305523 0.79 DPP4 (1.00) DPP4
SCHEMBL19313422 0.79 DPP4 (1.00) DPP4
SCHEMBL19538254 0.79 DPP4 (0.64) DPP4KDM4EALDH1A1GAAMAPT
SCHEMBL19538253 0.79 DPP4 (0.64) DPP4KDM4EALDH1A1GAAMAPT
SCHEMBL19313365 0.77 DPP4 (0.64) DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10479798-B2 Six-membered ring benzo derivatives as DPP-4 inhibitor and use thereof EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2019-11-19 US disclosed
US-20170313715-A1 SIX-MEMBERED RING BENZO DERIVATIVES AS DPP-4 INHIBITOR AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2017-11-02 US disclosed
EP-3214079-A1 SIX-MEMBERED RING BENZO DERIVATIVES AS DPP-4 INHIBITOR AND USE THEREOF East China University Of Science And Technology (CN) 2017-09-06 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 (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-10479798-B2 Six-membered ring benzo derivatives as DPP-4 inhibitor and use thereof DPP4, DPP7, DPP3 DPP4 1/4885KDM4E 251/4885ALDH1A1 379/4885
US-20170313715-A1 SIX-MEMBERED RING BENZO DERIVATIVES AS DPP-4 INHIBITOR AND USE THEREOF DPP4, DPP7, DPP3 DPP4 1/4885KDM4E 251/4885ALDH1A1 379/4885

“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.