SCHEMBL7189951

SCHEMBL7189951

CCOC(=O)N(C)c1c(O)ccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.46
MAPT P10636 4/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
NCEH1 Q6PIU2 4/20 0.44
MAPK1 P28482 2/20 0.44
HSD17B10 Q99714 1/20 0.44
HPGD P15428 1/20 0.43
CDC25B P30305 1/20 0.43
MEN1 O00255 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
MITF O75030 1/20 0.41

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
SCHEMBL7191292 0.83 WDR5 (0.46) KDM4EALDH1A1KMT2AGAATDP1
SCHEMBL7186521 0.83 MAPT (0.44) KDM4EMAPTALDH1A1KMT2AGAA
SCHEMBL7542797 0.82 ALDH1A1 (0.41) KDM4EMAPTALDH1A1KMT2ATDP1
SCHEMBL7189886 0.81 PTPN1 (0.49) KDM4EMAPTALDH1A1KMT2AGAA
SCHEMBL7190529 0.80 PTPN1 (0.45) KDM4EMAPTALDH1A1KMT2AGAA
SCHEMBL6249497 0.79 PTPN1 (0.50) KDM4EMAPTALDH1A1KMT2AGAA
SCHEMBL11570035 0.78 SIGMAR1 (0.56) KDM4EALDH1A1KMT2ANCEH1HPGD
SCHEMBL28257925 0.76 CA12 (0.64) KDM4EMAPTALDH1A1KMT2AGAA
SCHEMBL7190582 0.75 PTPN1 (0.43) KDM4EMAPTALDH1A1KMT2AGAA
SCHEMBL7191106 0.73 CA12 (0.55) KDM4EMAPTALDH1A1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1304924-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS Bayer Aktiengesellschaft (DE) 2003-05-02 EP disclosed
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 US disclosed
WO-2002005646-A2 COMPOSITIONS FOR REPELLING CRAWLING INSECTS S.C. JOHNSON & SON, INC. (US) (US) 2002-01-24 WO 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 KDM4E 3406/4885MAPT 3240/4885ALDH1A1 1488/4885

“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.