SCHEMBL5593775

SCHEMBL5593775

O=c1cc(Cl)sn1Cc1cccc(I)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 9/20 0.49
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ G6PD P11413 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HTR2C P28335 1/20 0.38
▸ IDO1 P14902 2/20 0.38
▸ SIGMAR1 Q99720 1/20 0.38
▸ GSK3A P49840 1/20 0.37
▸ GSK3B P49841 1/20 0.37
▸ CASP3 P42574 1/20 0.36
▸ FAAH O00519 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
SCHEMBL5593712 0.83 KAT2B (0.55) KAT2BALDH1A1MAPTG6PDPKM
SCHEMBL80967 0.83 KAT2B (0.58) KAT2BALDH1A1MAPTG6PDPKM
Hydrochloric Acid SCHEMBL9517520 0.82 KAT2B (0.56) KAT2BALDH1A1MAPTG6PDPKM
SCHEMBL14640434 0.79 KAT2B (0.46) KAT2BALDH1A1MAPTG6PDPKM
SCHEMBL5593916 0.77 KAT2B (0.47) KAT2BALDH1A1MAPTHPGDHTT
SCHEMBL678175 0.76 KAT2B (0.58) KAT2BMAPTIDO1
SCHEMBL5593649 0.76 ALDH1A1 (0.65) ALDH1A1MAPTG6PDPKMHPGD
SCHEMBL14640439 0.76 KAT2B (0.46) KAT2BALDH1A1MAPTG6PDPKM
SCHEMBL5593629 0.75 KAT2B (0.49) KAT2BALDH1A1MAPTG6PDPKM
SCHEMBL14640430 0.74 KAT2B (0.41) KAT2BALDH1A1MAPTG6PDPKM

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 2 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
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 1199/4885ALDH1A1 850/4885MAPT 4762/4885

“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.

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