SCHEMBL7185632

SCHEMBL7185632

CCOC(=S)N(c1ccccc1)c1ccc(C(=O)O)cc1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.40
NSD2 O96028 1/20 0.40
ESR1 P03372 1/20 0.40
APEX1 P27695 1/20 0.40
RECQL P46063 1/20 0.40
ESR2 Q92731 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 5/20 0.38
ALDH1A1 P00352 4/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 4/20 0.37
CASP6 P55212 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL7195265 0.94 HRH3 (0.37) KDM4EKMT2AALDH1A1RAB9ANPC1
SCHEMBL7183116 0.90 ESR1 (0.41) POLBESR1ESR2TDP1L3MBTL1
SCHEMBL7191776 0.87 ALDH1A1 (0.39) POLBNSD2ESR1APEX1RECQL
SCHEMBL7184680 0.87 POLB (0.41) POLBNSD2ESR1APEX1RECQL
SCHEMBL7183302 0.86 MEN1 (0.40) POLBNSD2KMT2AALDH1A1RAB9A
SCHEMBL7195416 0.85 TSHR (0.44) POLBKMT2AALDH1A1RAB9ANPC1
SCHEMBL7191598 0.81 HRH3 (0.39) KMT2AALDH1A1RAB9ANPC1HTT
SCHEMBL7192752 0.78 ESR1 (0.43) POLBESR1ESR2TDP1L3MBTL1
SCHEMBL7191778 0.77 CA12 (0.42) ESR1ESR2KMT2AALDH1A1NPC1
SCHEMBL7196068 0.76 KMT2A (0.38) POLBNSD2KDM4EKMT2AALDH1A1

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 POLB 3165/4885NSD2 2998/4885ESR1 4390/4885

“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.