SCHEMBL14938327

SCHEMBL14938327

CCN(C(=O)NN1CCNC1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 2/20 0.46
GLA P06280 1/20 0.46
TSHR P16473 1/20 0.46
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
TP53 P04637 2/20 0.39
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
OPRM1 P35372 2/20 0.37
OPRD1 P41143 1/20 0.37
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SIGMAR1 Q99720 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
SCHEMBL14938320 0.87 MEN1 (0.36) MEN1KMT2AALDH1A1GLATSHR
SCHEMBL14938311 0.80 CHRM2 (0.33) ALDH1A1TSHRSMN1; SMN2OPRM1OPRD1
SCHEMBL14543277 0.73 PKM (0.46) KMT2AALDH1A1TSHRSMN1; SMN2OPRD1
SCHEMBL4954832 0.72 ALDH1A1 (0.41) MEN1KMT2AALDH1A1GLATSHR
SCHEMBL4558907 0.71 ALDH1A1 (0.50) MEN1KMT2AALDH1A1GLATSHR
SCHEMBL4558670 0.71 ALDH1A1 (0.50) MEN1KMT2AALDH1A1GLATSHR
SCHEMBL966694 0.70 MEN1 (0.69) MEN1KMT2AALDH1A1GLATSHR
SCHEMBL2640927 0.70 MEN1 (0.69) MEN1KMT2AALDH1A1GLATSHR
SCHEMBL965733 0.69 MEN1 (0.67) MEN1KMT2AALDH1A1GLATSHR
SCHEMBL4294745 0.69 MEN1 (0.67) MEN1KMT2AALDH1A1GLATSHR

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 MEN1 4449/4885KMT2A 4728/4885ALDH1A1 3811/4885

“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.