SCHEMBL3238093

SCHEMBL3238093

CCOC(=O)CN(C(=O)/C=C/c1ccc(C(=O)Oc2ccc(C(=N)N)cc2)cc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.53
PRSS1 P07477 5/20 0.53
KLK1 P06870 4/20 0.53
TRPM8 Q7Z2W7 5/20 0.49
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HSP90AA1 P07900 1/20 0.43
HPGD P15428 1/20 0.43
F10 P00742 2/20 0.42
ITGB3 P05106 2/20 0.42
ITGA2B P08514 2/20 0.42
ACR P10323 1/20 0.41
PPARG P37231 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL7617141 0.90 TRPM8 (0.46) F2PRSS1KLK1TRPM8MAPT
SCHEMBL7617144 0.90 TRPM8 (0.46) F2PRSS1KLK1TRPM8MAPT
Hydrochloric Acid SCHEMBL7616006 0.89 TRPM8 (0.45) F2PRSS1KLK1TRPM8MAPT
Hydrochloric Acid SCHEMBL7616011 0.89 TRPM8 (0.45) F2PRSS1KLK1TRPM8MAPT
SCHEMBL7523243 0.87 F2 (0.47) F2PRSS1KLK1TRPM8MAPT
SCHEMBL3243842 0.87 PRSS1 (0.53) F2PRSS1KLK1MAPTKMT2A
SCHEMBL7192286 0.87 F2 (0.47) F2PRSS1KLK1TRPM8MAPT
SCHEMBL3243839 0.87 PRSS1 (0.53) F2PRSS1KLK1MAPTKMT2A
SCHEMBL3232966 0.86 PRSS1 (0.53) F2PRSS1KLK1MAPTKMT2A
SCHEMBL7303571 0.84 PRSS1 (0.69) F2PRSS1KLK1MAPTKMT2A

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-7671057-B2 Therapeutic agent for type II diabetes comprising protease-inhibiting compound ONO PHARMACEUTICAL CO., LTD. (JP) 2010-03-02 US disclosed
US-20080009537-A1 Therapeutic Agent for Diabetes Comprising Protease-Inhibiting Compound ONO PHARMACEUTICAL CO., LTD. (JP) 2008-01-10 US 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-20080009537-A1 Therapeutic Agent for Diabetes Comprising Protease-Inhibiting Compound DPP4, IAPP, DPP7 F2 805/4885PRSS1 25/4885KLK1 298/4885

“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.