SCHEMBL6294117

SCHEMBL6294117

CN1N=C(c2ccccc2O)CC1c1nccs1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.50
▸ MAOB P27338 7/20 0.46
▸ MAOA P21397 7/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ AOC1 P19801 2/20 0.43

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
SCHEMBL6297386 0.78 MAOB (0.49) PKMMAOBMAOAMEN1KMT2A
SCHEMBL11713041 0.77 MEN1 (0.69) MAOBMAOAMEN1KMT2AHSP90AA1
SCHEMBL27277013 0.67 PKM (1.00) PKMMAOBMAOAAOC1
SCHEMBL6292980 0.64 MEN1 (0.45) PKMMAOBMAOAMEN1KMT2A
SCHEMBL6298325 0.64 ESD (0.60) MAOBMAOAMEN1KMT2AHSP90AA1
SCHEMBL6294160 0.63 ESD (0.58) PKMMAOBMAOAMEN1KMT2A
SCHEMBL23297 0.63 PDPK1 (0.53) HSP90AA1
SCHEMBL29658188 0.63 PDPK1 (0.53) HSP90AA1
SCHEMBL6294300 0.63 ESD (0.63) MAOBMAOAMEN1KMT2AHSP90AA1
SCHEMBL5945842 0.62 PDPK1 (0.52) HSP90AA1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030083351-A1 Medicinal uses of dihydropyrazoles THE PROCTER & GAMBLE COMPANY 2003-05-01 — — US claimed
WO-2002089799-A2 USE OF DIHYDROPYRAZOLES TO INCREASE ERYTHROPOIETIN AND VASCULARI ZATION THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 — — WO claimed
US-20050090532-A1 Medicinal uses of dihydropyrazoles THE PROCTER & GAMBLE COMPANY 2005-04-28 — — US disclosed
US-6878729-B2 Medicinal uses of dihydropyrazoles THE PROCTER & GAMBLE COMPANY (US) 2005-04-12 — — US disclosed
US-20030083351-A1 Medicinal uses of dihydropyrazoles THE PROCTER & GAMBLE COMPANY 2003-05-01 — — US disclosed
WO-2002089799-A2 USE OF DIHYDROPYRAZOLES TO INCREASE ERYTHROPOIETIN AND VASCULARI ZATION THE PROCTER & GAMBLE COMPANY (US) 2002-11-14 — — WO 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 (2 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-20050090532-A1 Medicinal uses of dihydropyrazoles EPOR, VEGFA, FLT4 PKM 732/4885MAOB 437/4885MAOA 816/4885
US-20030083351-A1 Medicinal uses of dihydropyrazoles EPOR, VEGFA, TEK PKM 777/4885MAOB 716/4885MAOA 1212/4885

“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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