SCHEMBL7187730

SCHEMBL7187730

CCOC(=O)Nc1c(C(=O)O)ccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.62
POLB P06746 2/20 0.62
GLA P06280 1/20 0.62
HPGD P15428 5/20 0.59
ALDH1A1 P00352 3/20 0.59
WDR5 P61964 1/20 0.47
LDHA P00338 1/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
CDC25B P30305 2/20 0.45
CDC25A P30304 1/20 0.45
CDC25C P30307 1/20 0.45
HSD17B10 Q99714 4/20 0.45
MAPK1 P28482 2/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 1/20 0.45
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43

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
SCHEMBL7192942 0.86 POLB (0.48) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL11520630 0.83 KDM4E (0.55) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL10447849 0.83 ALDH1A1 (0.71) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL7746823 0.79 ABCC9 (0.56) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL11765835 0.78 KDM4E (0.76) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL7537626 0.78 ALDH1A1 (0.50) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL20164217 0.78 KDM4E (0.55) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL15111817 0.78 WDR5 (0.54) KDM4EPOLBHPGDALDH1A1WDR5
SCHEMBL11768676 0.77 KDM4E (0.61) KDM4EPOLBGLAHPGDALDH1A1
SCHEMBL1095326 0.77 NLRP3 (0.61) KDM4EPOLBGLAHPGDALDH1A1

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 3406/4885POLB 3165/4885GLA 4282/4885

“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.