SCHEMBL7203066

SCHEMBL7203066

O=C(CC(=O)c1cccs1)c1cccc(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 2/20 0.56
FEN1 P39748 2/20 0.56
CTNNB1 P35222 1/20 0.56
RAB9A P51151 6/20 0.52
NPC1 O15118 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
HTT P42858 1/20 0.52
LMNA P02545 3/20 0.52
HPGD P15428 3/20 0.52
GSK3B P49841 1/20 0.51
POLB P06746 3/20 0.50
ALDH1A1 P00352 3/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 3/20 0.47
KDM4E B2RXH2 2/20 0.47
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KCNMA1 Q12791 1/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL7201296 0.88 CTNNB1 (0.55) ERCC5FEN1CTNNB1RAB9ANPC1
SCHEMBL29962144 0.83 ERCC5 (0.76) ERCC5FEN1RAB9ANPC1SMN1; SMN2
SCHEMBL11791699 0.83 ERCC5 (0.76) ERCC5FEN1RAB9ANPC1SMN1; SMN2
SCHEMBL7200564 0.83 RAB9A (0.67) ERCC5FEN1CTNNB1RAB9ANPC1
SCHEMBL1859778 0.82 RAB9A (0.70) RAB9ANPC1SMN1; SMN2LMNAPOLB
SCHEMBL7205497 0.82 MAPT (0.69) ERCC5FEN1CTNNB1RAB9ANPC1
SCHEMBL7205860 0.82 KCNK3 (0.59) ERCC5FEN1CTNNB1RAB9ANPC1
SCHEMBL5591953 0.81 HPGDS (0.62) RAB9ANPC1SMN1; SMN2HTTLMNA
SCHEMBL1436183 0.80 ERCC5 (0.66) ERCC5FEN1CTNNB1RAB9ANPC1
SCHEMBL711360 0.80 RAB9A (0.75) ERCC5FEN1CTNNB1RAB9ANPC1

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 ERCC5 2903/4885FEN1 3825/4885CTNNB1 2248/4885

“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.