SCHEMBL13709650

SCHEMBL13709650

CC(O)c1ccc2cc(C(=N)N)sc2c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 13/20 0.43
▸ F10 P00742 7/20 0.43
▸ C1S P09871 2/20 0.43
▸ CFD P00746 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ UGT2B7 P16662 1/20 0.42
▸ PLAU P00749 5/20 0.42
▸ PLG P00747 1/20 0.40

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
SCHEMBL26110187 0.79 GPR35 (0.53) HDAC6UGT2B7
Hydrochloric Acid SCHEMBL9431648 0.76 HDAC6 (0.57) F9F10C1SCFDHDAC6
Hydrochloric Acid SCHEMBL9432456 0.75 F9 (0.56) F9F10PLAU
SCHEMBL13709514 0.75 HSD17B1 (0.51) F9F10C1SCFDHDAC6
SCHEMBL13709631 0.75 F9 (0.49) F9F10C1SCFDHDAC6
SCHEMBL13709506 0.73 F9 (0.47) F9F10C1SCFDHDAC6
SCHEMBL13709512 0.73 F9 (0.56) F9F10C1SCFDHDAC6
SCHEMBL3504110 0.73 PTPN2 (0.46) HDAC6UGT2B7
Hydrochloric Acid SCHEMBL9431276 0.72 PLAU (0.51) F9F10C1SCFDHDAC6
SCHEMBL13709655 0.72 CA2 (0.56) F9F10C1SCFDHDAC6

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
US-20090221564-A1 Heterocyclic Compounds and Their Use in the Treatment of Cardiovascular Disease TRIGEN LIMITED (GB) 2009-09-03 — — US disclosed
US-20090221564-A1 Heterocyclic Compounds and Their Use in the Treatment of Cardiovascular Disease TRIGEN LIMITED (GB) 2009-09-03 — — 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-20090221564-A1 Heterocyclic Compounds and Their Use in the Treatment of Cardiovascular Disease F12, F5, F3 F9 5/4885F10 7/4885C1S 45/4885

“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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