SCHEMBL7538697

SCHEMBL7538697

O=S(=O)(Oc1cccc2ccccc12)c1cc(O)c2ccccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
GAA P10253 3/20 0.49
ESR1 P03372 2/20 0.49
ESR2 Q92731 2/20 0.49
NQO2 P16083 1/20 0.42
CYP1A2 P05177 3/20 0.42
CYP2C9 P11712 2/20 0.41
TSHR P16473 1/20 0.41
PTPRA P18433 1/20 0.41
PTPRB P23467 1/20 0.41
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
RAPGEF4 Q8WZA2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HSD11B1 P28845 1/20 0.40
HSD17B3 P37058 1/20 0.40
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
CA1 P00915 1/20 0.40

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
SCHEMBL8959237 0.87 CASP6 (0.50) KMT2AMEN1GAAESR1ESR2
SCHEMBL7195634 0.82 NR4A1 (0.49) KMT2AMEN1GAAESR1ESR2
SCHEMBL27677443 0.81 NQO2 (0.50) NQO2CYP1A2CYP2C9TSHRPTPRA
SCHEMBL7188643 0.80 ESR1 (0.56) KMT2AMEN1GAAESR1ESR2
SCHEMBL6571754 0.80 CASP6 (0.51) KMT2AMEN1GAAESR1ESR2
SCHEMBL27677444 0.80 NQO2 (0.48) NQO2CYP1A2CYP2C9TSHRPTPRA
SCHEMBL3933078 0.79 METAP2 (0.59) KMT2AMEN1GAAESR1ESR2
SCHEMBL10878438 0.79 MEN1 (0.49) KMT2AMEN1GAAESR1ESR2
SCHEMBL29077017 0.78 METAP2 (0.58) KMT2AMEN1GAAESR1ESR2
SCHEMBL8837674 0.78 MEN1 (0.50) KMT2AMEN1GAAESR1ESR2

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 KMT2A 3439/4885MEN1 3828/4885GAA 4156/4885

“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.