SCHEMBL9862096

SCHEMBL9862096

CCOCc1ccccc1CN

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PNMT P11086 2/20 0.41
DPP4 P27487 2/20 0.39
IDO1 P14902 9/20 0.38
TAAR1 Q96RJ0 4/20 0.35

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
SCHEMBL648250 0.89 IDO1 (0.39) KDM4EDPP4IDO1
SCHEMBL8750546 0.82 L3MBTL1 (0.44) KDM4EIDO1
SCHEMBL18892799 0.80 NPSR1 (0.37) SMN1; SMN2DPP4IDO1
SCHEMBL8846751 0.78 DPP4 (0.35) KDM4EDPP4IDO1TAAR1
SCHEMBL29618473 0.78 CYP4F2 (0.49) KDM4EIDO1
SCHEMBL7689047 0.78 ALDH1A1 (0.47) SMN1; SMN2IDO1
SCHEMBL3149558 0.78 TSHR (0.35) DPP4IDO1
SCHEMBL19535134 0.78 IDO1 (0.57) KDM4EDPP4IDO1TAAR1
SCHEMBL18892755 0.78 CYP4F2 (0.49) KDM4EIDO1
SCHEMBL21796063 0.77 TACR1 (0.38) KDM4EDPP4IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3030560-B1 BENZIMIDAZOLYL-METHYL UREA DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2017-06-21 EP disclosed
US-9663473-B2 Benzimidazolyl-methyl urea derivatives as ALX receptor agonists ACTELION PHARMACEUTICALS LTD. (CH) 2017-05-30 US disclosed
US-20160200686-A1 BENZIMIDAZOLYL-METHYL UREA DERIVATIVES AS ALX RECEPTOR AGONISTS IDORSIA PHARMACEUTICALS LTD (CH) 2016-07-14 US disclosed
EP-3030560-A1 BENZIMIDAZOLYL-METHYL UREA DERIVATIVES AS ALX RECEPTOR AGONISTS Actelion Pharmaceuticals Ltd (CH) 2016-06-15 EP disclosed
WO-2015019325-A1 BENZIMIDAZOLYL-METHYL UREA DERIVATIVES AS ALX RECEPTOR AGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2015-02-12 WO disclosed
US-4992588-A Preparation of o-acylaminomethylbenzyl halides BASF AKTIENGESELLSCHAFT (DE) 1991-02-12 US disclosed
EP-0087676-B1 PROCESS FOR THE PREPARATION OF O-ACYLAMINOMETHYLBENZYL HALOGENIDES BASF Aktiengesellschaft (DE) 1987-12-16 EP disclosed
EP-0087676-A1 Process for the preparation of o-acylaminomethylbenzyl halogenides BASF Aktiengesellschaft (DE) 1983-09-07 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-20160200686-A1 BENZIMIDAZOLYL-METHYL UREA DERIVATIVES AS ALX RECEPTOR AGONISTS UTS2R, ADORA3, P2RX7 KDM4E 571/4885SMN1; SMN2 3377/4885PNMT 1400/4885

“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.