SCHEMBL7205860

SCHEMBL7205860

Cc1cccc(C(=O)CC(=O)c2cccs2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 1/20 0.59
KCNK9 Q9NPC2 1/20 0.59
KMT2A Q03164 6/20 0.59
MEN1 O00255 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
PKM P14618 2/20 0.59
GAA P10253 2/20 0.59
CTNNB1 P35222 1/20 0.56
NPC1 O15118 7/20 0.54
RAB9A P51151 7/20 0.54
HPGD P15428 3/20 0.54
ALDH1A1 P00352 5/20 0.52
MAPK1 P28482 1/20 0.52
ERCC5 P28715 1/20 0.51
FEN1 P39748 1/20 0.51
LMNA P02545 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL15979659 0.88 NPC1 (0.64) KCNK3KCNK9KMT2AMEN1SMN1; SMN2
SCHEMBL28728190 0.83 MEN1 (0.64) KCNK3KCNK9KMT2AMEN1SMN1; SMN2
SCHEMBL29456641 0.83 MEN1 (0.64) KCNK3KCNK9KMT2AMEN1SMN1; SMN2
SCHEMBL7207262 0.83 NPC1 (0.67) KMT2AMEN1SMN1; SMN2PKMGAA
SCHEMBL7203066 0.82 ERCC5 (0.56) KMT2AMEN1SMN1; SMN2CTNNB1NPC1
SCHEMBL9062742 0.81 CNR1 (0.65) KCNK3KCNK9KMT2AMEN1SMN1; SMN2
SCHEMBL1436183 0.80 ERCC5 (0.66) KMT2AMEN1SMN1; SMN2CTNNB1NPC1
SCHEMBL711360 0.80 RAB9A (0.75) KMT2AMEN1SMN1; SMN2PKMCTNNB1
SCHEMBL7207744 0.79 NPC1 (0.61) KMT2AMEN1SMN1; SMN2PKMGAA
SCHEMBL30001736 0.79 MEN1 (0.69) KCNK3KCNK9KMT2AMEN1SMN1; SMN2

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 KCNK3 932/4885KCNK9 2556/4885KMT2A 3922/4885

“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.