SCHEMBL7536346

SCHEMBL7536346

O=C(O)c1ccc(OOc2ccccc2C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 6/20 0.49
HPGD P15428 5/20 0.49
HSD17B10 Q99714 5/20 0.49
SRD5A2 P31213 3/20 0.49
TSHR P16473 3/20 0.49
NAPRT Q6XQN6 2/20 0.49
PKM P14618 1/20 0.49
ESR1 P03372 1/20 0.49
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
HMGB1 P09429 1/20 0.49
GGT1 P19440 1/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
BLM P54132 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
USP2 O75604 1/20 0.47

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
SCHEMBL7191217 0.89 ALDH1A1 (0.59) CA1CA2ALDH1A1KDM4EHPGD
SCHEMBL29010714 0.84 KDM4E (0.63) CA1CA2ALDH1A1KDM4EHPGD
SCHEMBL920326 0.84 SRD5A2 (0.59) ALDH1A1KDM4EHPGDHSD17B10SRD5A2
SCHEMBL7191723 0.82 CA1 (0.50) CA1CA2SRD5A2TSHRNAPRT
SCHEMBL7184555 0.81 TTR (0.54) CA1CA2ALDH1A1KDM4EHPGD
SCHEMBL6746609 0.80 TSHR (0.67) CA1CA2ALDH1A1HSD17B10SRD5A2
SCHEMBL17010762 0.80 KDM4E (0.50) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL7190620 0.78 LMNA (0.50) CA1CA2ALDH1A1HPGDSRD5A2
SCHEMBL31633357 0.78 ALDH1A1 (0.56) CA1CA2ALDH1A1KDM4EHPGD
SCHEMBL11273464 0.76 KDM4E (0.64) ALDH1A1KDM4EHPGDHSD17B10TSHR

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 CA1 1889/4885CA2 1428/4885ALDH1A1 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.