SCHEMBL7184555

SCHEMBL7184555

O=C(O)c1ccc(OOc2ccccc2)c(C(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.54
KDM4E B2RXH2 4/20 0.50
AKR1C3 P42330 1/20 0.47
POLB P06746 2/20 0.46
CASP6 P55212 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA7 P43166 1/20 0.44
TPMT P51580 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
RAB9A P51151 3/20 0.43
LMNA P02545 2/20 0.43
CDC25A P30304 1/20 0.43
CDC25B P30305 1/20 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
SCHEMBL184391 0.84 TTR (0.70) TTRKDM4EAKR1C3POLBCASP6
SCHEMBL7191617 0.83 TTR (0.73) TTRKDM4EAKR1C3POLBCASP6
SCHEMBL7536346 0.81 CA1 (0.50) KDM4EALDH1A1HPGDCA1CA2
SCHEMBL7188637 0.80 MRGPRX4 (0.53) KDM4EPOLBALDH1A1HPGDRAB9A
SCHEMBL7191217 0.80 ALDH1A1 (0.59) KDM4EALDH1A1HPGDCA12CA1
SCHEMBL7542886 0.79 TTR (0.50) TTRKDM4EAKR1C3POLBCASP6
SCHEMBL2588487 0.77 CA12 (0.53) TTRKDM4EPOLBALDH1A1CA12
SCHEMBL31186537 0.77 TTR (0.59) TTRKDM4EAKR1C3POLBALDH1A1
SCHEMBL29118338 0.76 AKR1C3 (0.71) KDM4EAKR1C3CA12CA1CA2
SCHEMBL11337000 0.75 TTR (0.57) TTRKDM4EAKR1C3POLBALDH1A1

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 TTR 2691/4885KDM4E 3406/4885AKR1C3 3064/4885

“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.