SCHEMBL19313402

SCHEMBL19313402

O=c1ccc2ccc3c(c2o1)CCC(c1cc(F)c(F)cc1F)O3

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 12/20 0.61
▸ KDM4E B2RXH2 5/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ HPGD P15428 4/20 0.43
▸ GAA P10253 1/20 0.43
▸ CYP3A4 P08684 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ ABCB1 P08183 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ GAPDH P04406 1/20 0.36

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
SCHEMBL19313330 0.81 DPP4 (0.64) DPP4KDM4EALDH1A1HPGDGAA
SCHEMBL19313331 0.81 DPP4 (0.64) DPP4KDM4EALDH1A1HPGDGAA
SCHEMBL19305520 0.76 DPP4 (1.00) DPP4
SCHEMBL19313349 0.76 DPP4 (1.00) DPP4
SCHEMBL24101338 0.76 DPP4 (1.00) DPP4
SCHEMBL19313443 0.76 DPP4 (0.60) DPP4KDM4EHPGDHSD17B10
SCHEMBL22135594 0.74 DPP4 (0.56) DPP4KDM4EALDH1A1HPGDGAA
SCHEMBL19313300 0.74 DPP4 (0.61) DPP4
SCHEMBL19313432 0.72 DPP4 (0.64) DPP4
SCHEMBL24101376 0.71 DPP4 (0.63) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3214079-B1 SIX-MEMBERED RING BENZO DERIVATIVES AS DPP-4 INHIBITOR AND USE THEREOF UNIV EAST CHINA SCIENCE & TECH (CN) 2020-06-24 — — EP disclosed
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.

Send feedback