SCHEMBL7200952

SCHEMBL7200952

O=C(CC(=O)c1cccs1)c1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
MAPT P10636 4/20 0.58
LMNA P02545 2/20 0.58
CTNNB1 P35222 1/20 0.57
ERCC5 P28715 1/20 0.57
FEN1 P39748 1/20 0.57
RAB9A P51151 6/20 0.56
ALDH1A1 P00352 4/20 0.56
NPC1 O15118 3/20 0.56
POLB P06746 3/20 0.56
ALPG P10696 1/20 0.56
GSK3B P49841 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 2/20 0.49
KDM4E B2RXH2 2/20 0.47
GAA P10253 2/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL15988919 0.86 POLB (0.72) MEN1KMT2AMAPTLMNACTNNB1
SCHEMBL1436183 0.86 ERCC5 (0.66) MEN1KMT2AMAPTLMNACTNNB1
SCHEMBL711360 0.85 RAB9A (0.75) MEN1KMT2ALMNACTNNB1ERCC5
SCHEMBL7200564 0.85 RAB9A (0.67) MEN1KMT2AMAPTLMNACTNNB1
SCHEMBL7207262 0.85 NPC1 (0.67) MEN1KMT2AMAPTLMNACTNNB1
SCHEMBL7206410 0.85 CTNNB1 (0.56) MEN1KMT2AMAPTLMNACTNNB1
SCHEMBL7202020 0.85 CTNNB1 (0.56) MEN1KMT2AMAPTLMNACTNNB1
SCHEMBL7202370 0.85 CTNNB1 (0.56) MEN1KMT2ALMNACTNNB1ERCC5
SCHEMBL7205003 0.83 ERCC5 (0.58) MEN1KMT2AMAPTLMNACTNNB1
SCHEMBL28816497 0.83 CTNNB1 (0.55) MEN1KMT2AMAPTLMNACTNNB1

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-6605730-B2 3-(2-Thienyl)-5-phenyl-1H-pyrazole compounds of given formula NIHON BAYER AGROCHEM K.K. (JP) 2003-08-12 US disclosed
US-20030028034-A1 Nematicidal pyrazoles WADA KATSUAKI (JP) 2003-02-06 US disclosed
US-6310049-B1 3-(2-THIENYL),5-(SUBSTITUTED PHENYL)-1H-PYRAZOLES AND 3-(SUBSTITUTED PHENYL),5-(2-THIENYL)-1H-PYRAZOLES OF GIVEN FORMULA; ANTHELMINTICS NIHON BAYER AGROCHEM K.K. (JP) 2001-10-30 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-20030028034-A1 Nematicidal pyrazoles CBR3, CBR1, CCR4 MEN1 4820/4885KMT2A 3922/4885MAPT 4683/4885

“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.