SCHEMBL7187596

SCHEMBL7187596

CC(OC(N)=O)(c1ccc(C(=O)O)cc1)c1ccccc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
SRD5A2 P31213 1/20 0.41
RBP4 P02753 1/20 0.40
RXRA P19793 3/20 0.40
RXRB P28702 3/20 0.40
RXRG P48443 1/20 0.40
TNF P01375 1/20 0.38
KLF5 Q13887 1/20 0.38
NOD1 Q9Y239 1/20 0.38
RARB P10826 1/20 0.38
RARG P13631 1/20 0.38
KMT2A Q03164 2/20 0.37
TSHR P16473 1/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
NR1H4 Q96RI1 3/20 0.36
PPARG P37231 2/20 0.36
CDC25A P30304 1/20 0.36
CDC25B P30305 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL7183172 0.91 MAPT (0.43) TDP1KMT2ATSHRCYP1A2HSD17B10
SCHEMBL7191603 0.86 TDP1 (0.43) TDP1SRD5A2RXRARXRBRXRG
SCHEMBL7184685 0.85 KDM4E (0.41) TDP1RBP4RXRARXRBRXRG
SCHEMBL7542207 0.83 RBP4 (0.38) TDP1SRD5A2RBP4RXRARXRB
SCHEMBL7192758 0.80 TDP1 (0.39) TDP1SRD5A2RXRARXRBRARB
SCHEMBL7183310 0.77 KCNK2 (0.40) TDP1SRD5A2RBP4RXRARXRB
SCHEMBL1296543 0.77 TDP1 (0.51) TDP1SRD5A2RXRARXRBRXRG
SCHEMBL7185639 0.77 ALDH1A1 (0.43) TDP1KMT2ATSHRCDC25BHSD17B10
SCHEMBL7196475 0.77 ALDH1A1 (0.42) TDP1SRD5A2RARBRARGKMT2A
SCHEMBL1363532 0.77 MAPT (0.57) TDP1TNFKLF5NOD1KMT2A

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 TDP1 3063/4885SRD5A2 4141/4885RBP4 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.