SCHEMBL5593574

SCHEMBL5593574

O=c1cc(Cl)sn1Cc1ccc(-n2cc(Cl)cn2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 8/20 0.43
CYP3A4 P08684 1/20 0.41
FEN1 P39748 1/20 0.37
HSD17B10 Q99714 1/20 0.36
MAP4K4 O95819 1/20 0.36
DRD4 P21917 4/20 0.36
HTR2C P28335 2/20 0.36
DRD2 P14416 2/20 0.36
DRD3 P35462 1/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MTOR P42345 1/20 0.34
RPTOR Q8N122 1/20 0.34
MLST8 Q9BVC4 1/20 0.34

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
SCHEMBL5593910 0.81 HSD17B10 (0.51) KAT2BCYP3A4FEN1HSD17B10MAP4K4
SCHEMBL5593769 0.78 NOTUM (0.50) KAT2BCYP3A4DRD4DRD2DRD3
SCHEMBL678175 0.77 KAT2B (0.58) KAT2B
SCHEMBL5593712 0.71 KAT2B (0.55) KAT2BHSD17B10ALDH1A1
SCHEMBL80967 0.71 KAT2B (0.58) KAT2BHSD17B10ALDH1A1
SCHEMBL11493879 0.70 QPCT (0.49) CYP3A4HSD17B10MAP4K4DRD4DRD2
Hydrochloric Acid SCHEMBL9517520 0.70 KAT2B (0.56) KAT2BHSD17B10ALDH1A1
SCHEMBL3655957 0.69 ALDH1A1 (0.57) KAT2BCYP3A4HSD17B10ALDH1A1
SCHEMBL11488816 0.68 CYP3A4 (0.38) CYP3A4HSD17B10MAP4K4DRD4HTR2C
SCHEMBL14640440 0.68 KAT2B (0.50) KAT2BHSD17B10ALDH1A1

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
WO-2007001932-A2 SUBSTITUTED ISOTHIAZOLONES AS INHIBITORS OF CYTOSOLIC PHOSPHOLIPASE A2 JANSSEN PHARMACEUTICA N.V. (BE) 2007-01-04 WO disclosed
WO-2007001932-A2 SUBSTITUTED ISOTHIAZOLONES AS INHIBITORS OF CYTOSOLIC PHOSPHOLIPASE A2 JANSSEN PHARMACEUTICA N.V. (BE) 2007-01-04 WO disclosed
US-20060293374-A1 Substituted isothiazolones JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-28 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-20060293374-A1 Substituted isothiazolones LTB4R2, PTGES2, CYSLTR2 KAT2B 1199/4885CYP3A4 919/4885FEN1 3736/4885

“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.