SCHEMBL7538726

SCHEMBL7538726

CC(OC(N)=O)Sc1c(-c2c(O)ccc3ccccc23)ccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
USP2 O75604 1/20 0.39
PAK1 Q13153 1/20 0.39
NSD2 O96028 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
HSP90AA1 P07900 8/20 0.36
HSP90AB1 P08238 8/20 0.36
DNMT1 P26358 1/20 0.35
STAT3 P40763 1/20 0.34
EPHX1 P07099 1/20 0.34
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.33
HTT P42858 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33

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
SCHEMBL7539711 0.90 EPHX1 (0.34) MEN1MAPTKMT2AUSP2PAK1
SCHEMBL7538427 0.87 WDR5 (0.50) MEN1MAPTKMT2ADNMT1EPHX1
SCHEMBL7540706 0.80 EPHX1 (0.33) MAPTEPHX1
SCHEMBL7544143 0.79 MEN1 (0.44) MEN1MAPTKMT2ANSD2OPRM1
SCHEMBL7539139 0.72 KDM4E (0.47) MEN1MAPTKMT2AKDM4EGAA
SCHEMBL23499962 0.69 NSD2 (0.46) MEN1MAPTKMT2AUSP2PAK1
SCHEMBL7538784 0.69 KDM4E (0.38) MEN1MAPTKMT2AHKDC1HSP90AA1
SCHEMBL7538617 0.67 KDM4E (0.50) MEN1MAPTKMT2AKDM4EGAA
SCHEMBL7539101 0.66 CA12 (0.36) MAPTEPHX1KDM4EALDH1A1
SCHEMBL22738263 0.66 IDO1 (0.54) MAPTUSP2PAK1NSD2OPRM1

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-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 MEN1 3828/4885MAPT 3240/4885KMT2A 3439/4885

“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.