SCHEMBL7183310

SCHEMBL7183310

CC(OC(N)=O)(Sc1ccc(C(=O)O)cc1)c1ccccc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK2 O95069 2/20 0.40
KCNK10 P57789 2/20 0.40
RBP4 P02753 1/20 0.38
RXRA P19793 2/20 0.38
RXRB P28702 2/20 0.38
RXRG P48443 2/20 0.38
TDP1 Q9NUW8 2/20 0.35
TSHR P16473 2/20 0.35
KDM4E B2RXH2 3/20 0.34
HSD17B10 Q99714 2/20 0.34
ALDH1A1 P00352 2/20 0.34
CDC25A P30304 1/20 0.34
CDC25B P30305 1/20 0.34
AKR1C3 P42330 1/20 0.33
F2 P00734 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
APEX1 P27695 1/20 0.33
POLB P06746 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
SCHEMBL7195421 0.92 SIRT1 (0.36) KCNK2KCNK10TDP1TSHRKDM4E
SCHEMBL7195266 0.87 TDP1 (0.35) KCNK2KCNK10RXRARXRBRXRG
SCHEMBL7185638 0.86 KDM4E (0.38) KCNK2KCNK10RBP4RXRARXRB
SCHEMBL7196070 0.84 RBP4 (0.36) KCNK2KCNK10RBP4RXRARXRB
SCHEMBL7183121 0.81 POLB (0.37) KCNK2KCNK10TDP1KDM4EAPEX1
SCHEMBL7185569 0.81 ALDH1A1 (0.38) TDP1TSHRKDM4EHSD17B10ALDH1A1
SCHEMBL7191783 0.79 ALDH1A1 (0.39) KCNK2KCNK10TDP1KDM4EHSD17B10
SCHEMBL7191785 0.78 MEN1 (0.36) KCNK2RXRARXRBRXRGTSHR
SCHEMBL7187596 0.77 TDP1 (0.43) RBP4RXRARXRBRXRGTDP1
SCHEMBL7185556 0.77 TSHR (0.41) TDP1TSHRKDM4EHSD17B10ALDH1A1

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 KCNK2 1806/4885KCNK10 2081/4885RBP4 1250/4885

“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.