SCHEMBL996654

SCHEMBL996654

Cc1onc(C(=O)O)c1C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.57
▸ GAA P10253 3/20 0.57
▸ LMNA P02545 2/20 0.57
▸ MAPT P10636 2/20 0.57
▸ RECQL P46063 1/20 0.49
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ BRD4 O60885 1/20 0.46
▸ TSHR P16473 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ PTPN1 P18031 1/20 0.44
▸ NPC1 O15118 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ SRD5A2 P31213 1/20 0.42
▸ CATSPER1 Q8NEC5 1/20 0.41

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
SCHEMBL27622444 0.88 SRD5A2 (0.52) ALDH1A1GAALMNAMAPTRECQL
SCHEMBL5211761 0.87 LMNA (0.47) ALDH1A1GAALMNAMAPTRECQL
SCHEMBL27622448 0.86 POLB (0.51) ALDH1A1GAALMNAMAPTRECQL
SCHEMBL27627423 0.85 LMNA (0.46) ALDH1A1GAALMNAMAPTRECQL
SCHEMBL27627404 0.84 CYP1A2 (0.48) ALDH1A1GAALMNAMAPTRECQL
SCHEMBL6175924 0.83 CA1 (0.50) ALDH1A1GAALMNAMAPTRECQL
SCHEMBL27622437 0.83 ALDH1A1 (0.47) ALDH1A1GAALMNAMAPTRECQL
SCHEMBL1323891 0.82 ALDH1A1 (0.60) ALDH1A1GAALMNAMAPTKMT2A
SCHEMBL994810 0.82 HTT (0.54) ALDH1A1GAALMNAMAPTTSHR
SCHEMBL27641421 0.81 LMNA (0.46) ALDH1A1GAALMNAMAPTRECQL

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
EP-2125830-B1 NEW PROCESS FOR PREPARING 3-METHYL-4-PHENYLISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-ONE ALMIRALL SA (ES) 2011-01-26 — — EP claimed
EP-2125830-B1 NEW PROCESS FOR PREPARING 3-METHYL-4-PHENYLISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-ONE ALMIRALL SA (ES) 2011-01-26 — — EP disclosed
EP-2125830-B1 NEW PROCESS FOR PREPARING 3-METHYL-4-PHENYLISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-ONE ALMIRALL SA (ES) 2011-01-26 — — EP disclosed
US-20100137591-A1 PROCESS FOR PREPARING 3-METHYL-4-PHENYLISOXAZOLO [3,4-D]PYRIDAZIN-7(6H)-ONE ALMIRALL, S.A. (ES) 2010-06-03 — — US disclosed
EP-2125830-A1 NEW PROCESS FOR PREPARING 3-METHYL-4-PHENYLISOXAZOLOÝ3,4-D¨PYRIDAZIN-7(6H)-ONE Almirall, S.A. (ES) 2009-12-02 — — EP disclosed
WO-2008107064-A1 NEW PROCESS FOR PREPARING 3-METHYL-4-PHENYLISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-ONE ALMIRALL S.A. (ES) 2008-09-12 — — 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 (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-20100137591-A1 PROCESS FOR PREPARING 3-METHYL-4-PHENYLISOXAZOLO [3,4-D]PYRIDAZIN-7(6H)-ONE HPD, CYP4F11, CYP4F8 ALDH1A1 215/4885GAA 3073/4885LMNA 2237/4885

“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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