SCHEMBL7189988

SCHEMBL7189988

O=C(O)c1ccc(S(=O)(=O)Oc2cccc3ccccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
GAA P10253 2/20 0.49
MEN1 O00255 2/20 0.49
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
TSHR P16473 1/20 0.48
MAPT P10636 2/20 0.47
MRGPRX4 Q96LA9 1/20 0.47
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HSD17B10 Q99714 1/20 0.43
ALOX5 P09917 1/20 0.43
DHODH Q02127 1/20 0.43
POLB P06746 1/20 0.43
PTPN1 P18031 1/20 0.42
DAPK1 P53355 1/20 0.42

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
SCHEMBL3933078 0.86 METAP2 (0.59) KMT2AGAAMEN1ESR1ESR2
SCHEMBL29077017 0.84 METAP2 (0.58) KMT2AGAAMEN1ESR1ESR2
SCHEMBL7188643 0.83 ESR1 (0.56) KMT2AGAAMEN1ESR1ESR2
SCHEMBL11701473 0.82 NR4A1 (0.45) KMT2AGAAMEN1ESR1ESR2
SCHEMBL8201685 0.80 HSD11B1 (0.61) KMT2AGAAMEN1ESR1ESR2
SCHEMBL1073454 0.80 MEN1 (0.68) KMT2AGAAMEN1ESR1ESR2
SCHEMBL28390792 0.80 HTR6 (0.55) KMT2AGAAMEN1ESR1ESR2
SCHEMBL7195634 0.79 NR4A1 (0.49) KMT2AGAAMEN1ESR1ESR2
SCHEMBL7536348 0.79 HPGD (0.54) KMT2AGAAMEN1TSHRMAPT
SCHEMBL7187556 0.79 MRGPRX4 (0.47) KMT2AGAAMEN1ESR1ESR2

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

“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.