SCHEMBL7539703

SCHEMBL7539703

O=C(O)c1ccc(Sc2ccccc2O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ TSHR P16473 2/20 0.46
▸ DAO P14920 1/20 0.46
▸ NAPRT Q6XQN6 1/20 0.46
▸ CES2 O00748 1/20 0.45
▸ CES1 P23141 1/20 0.45
▸ SRD5A2 P31213 1/20 0.45
▸ SIRT1 Q96EB6 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA3 P07451 1/20 0.43
▸ TYR P14679 1/20 0.43
▸ DRD1 P21728 1/20 0.43
▸ CA4 P22748 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
SCHEMBL10719463 0.87 HPGD (0.44) PKMALDH1A1HPGDSRD5A2SIRT1
SCHEMBL487237 0.82 SIRT1 (0.50) ALDH1A1HPGDTSHRSIRT1TDP1
SCHEMBL2024004 0.81 ALDH1A1 (0.59) PKMALDH1A1HPGDTSHRDAO
SCHEMBL24718397 0.80 RXRA (0.52) PKMALDH1A1HPGDTSHRDAO
SCHEMBL365542 0.80 PKM (0.49) PKMALDH1A1HPGDTSHRDAO
SCHEMBL689927 0.80 HPGD (0.69) PKMALDH1A1HPGDTSHRDAO
SCHEMBL5399446 0.78 NR1H2 (0.56) ALDH1A1HPGDTSHRSIRT1TDP1
Bicarbonate SCHEMBL11202875 0.78 KDM4E (0.46) PKMALDH1A1HPGDTSHRNAPRT
SCHEMBL4414886 0.77 HPGD (0.55) ALDH1A1HPGDTSHRCA12CA1
SCHEMBL7191097 0.77 PKM (0.46) PKMALDH1A1HPGDTSHRDAO

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
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 — — US disclosed
EP-0137395-B1 4-(HYDROXYPHENYLTHIO)-BENZOATES CIBA-GEIGY AG (CH) 1987-11-04 — — EP disclosed
EP-0137395-A2 4-(Hydroxyphenylthio)-benzoates CIBA-GEIGY AG (CH) 1985-04-17 — — EP 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 PKM 3300/4885ALDH1A1 1488/4885HPGD 3530/4885

“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.

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