SCHEMBL14938331

SCHEMBL14938331

CC(c1ccccc1)N(C(N)=O)N1CCNC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.48
OPRD1 P41143 9/20 0.42
TRPM8 Q7Z2W7 1/20 0.38
OPRM1 P35372 2/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
SLC6A4 P31645 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
OPRK1 P41145 1/20 0.35
SIGMAR1 Q99720 1/20 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
SCHEMBL14938323 0.87 DPP4 (0.34) ALOX5
SCHEMBL14938315 0.80 ALOX5 (0.52) ALOX5OPRM1KMT2AMEN1OPRK1
SCHEMBL27538699 0.76 ALOX5 (0.31) ALOX5
SCHEMBL17199879 0.74 L3MBTL1 (0.39) KMT2AMEN1SLC6A4
SCHEMBL27902890 0.73
SCHEMBL14938330 0.70 SIGMAR1 (0.39) ALOX5OPRM1KMT2AMEN1SLC6A4
SCHEMBL4167488 0.70 CA2 (0.32) HTR2AHTR2C
Propylene Glycol SCHEMBL27962622 0.68 TDP1 (0.32)
SCHEMBL27705053 0.68 OPRD1 (0.47) OPRD1OPRM1KMT2AMEN1SLC6A4
SCHEMBL1953504 0.67 ALOX5 (0.69) ALOX5TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130123215-A1 2,5-DIOXOIMIDAZOLIDIN-1-YL-3-PHENYLUREA DERIVATIVES AS FORMYL PEPTIDE RECEPTOR LIKE-1 (FPRL-1) RECEPTOR MODULATORS ALLERGAN, INC. (US) 2013-05-16 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-20130123215-A1 2,5-DIOXOIMIDAZOLIDIN-1-YL-3-PHENYLUREA DERIVATIVES AS FORMYL PEPTIDE RECEPTOR LIKE-1 (FPRL-1) RECEPTOR MODULATORS FPR1, FPR2, FPR3 ALOX5 398/4885OPRD1 199/4885TRPM8 262/4885

“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.