SCHEMBL10797162

SCHEMBL10797162

COCC(=O)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.67
▸ NR4A1 P22736 1/20 0.66
▸ NR4A2 P43354 1/20 0.66
▸ NR4A3 Q92570 1/20 0.66
▸ SMN1; SMN2 Q16637 8/20 0.63
▸ RAB9A P51151 7/20 0.63
▸ NPC1 O15118 6/20 0.63
▸ ALDH1A1 P00352 3/20 0.63
▸ EGFR P00533 2/20 0.63
▸ L3MBTL1 Q9Y468 2/20 0.63
▸ PARP10 Q53GL7 1/20 0.62
▸ PLA2G4B P0C869 1/20 0.61
▸ MAPT P10636 3/20 0.61
▸ HTT P42858 2/20 0.61
▸ GAA P10253 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ SRD5A2 P31213 1/20 0.60
▸ POLB P06746 1/20 0.56
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55

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
SCHEMBL1630447 0.86 NR4A1 (0.68) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL9787125 0.85 PLA2G4B (0.67) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL6811215 0.85 EGFR (0.68) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL102983 0.84 RAB9A (0.83) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL2503352 0.84 MAOB (0.69) MAOBNR4A1NR4A2NR4A3SRD5A2
SCHEMBL433676 0.83 MAOB (0.65) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL6760573 0.82 MAOB (0.60) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL1962776 0.82 MAOB (0.52) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL6533199 0.82 NPC1 (0.69) MAOBNR4A1NR4A2NR4A3SMN1; SMN2
SCHEMBL1960673 0.82 NR4A1 (0.72) MAOBNR4A1NR4A2NR4A3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101182289-B 4'-hydroxy-4,6'-dimethoxy dihydrocharcone and method for synthesizing the same UNIV SHANGHAI 2011-03-30 — — CN claimed
CN-101182289-A 4'-hydroxy-4,6'-dimethoxy dihydrocharcone and method for synthesizing the same UNIV SHANGHAI (CN) 2008-05-21 — — CN claimed
CN-111253385-A Heterocyclic compound, preparation method and application 遵义医科大学珠海校区 2020-06-09 — — CN disclosed
US-20190177327-A1 SUBSTITUTED METHYL PYRAZOLOPYRIMIDINONE AND METHYL IMIDAZOPYRAZINONE COMPOUNDS AS PDE1 INHIBITORS DART NEUROSCIENCE LLC (US) 2019-06-13 — — US disclosed
US-20190177327-A1 SUBSTITUTED METHYL PYRAZOLOPYRIMIDINONE AND METHYL IMIDAZOPYRAZINONE COMPOUNDS AS PDE1 INHIBITORS DART NEUROSCIENCE LLC (US) 2019-06-13 — — US disclosed
CN-101182289-B 4'-hydroxy-4,6'-dimethoxy dihydrocharcone and method for synthesizing the same UNIV SHANGHAI 2011-03-30 — — CN disclosed
CN-101182289-A 4'-hydroxy-4,6'-dimethoxy dihydrocharcone and method for synthesizing the same UNIV SHANGHAI (CN) 2008-05-21 — — CN disclosed
EP-0113236-B1 SUBSTITUTED IMIDAZOPYRIMIDINES-PYRAZINES, AND -TRIAZINES ELI LILLY AND COMPANY (US) 1987-04-22 — — EP disclosed
US-4636502-A Methods of producing a positive inotropic effect or vasodilation by administration of 2-phenyl imidazo pyrimidines and pyrazines ELI LILLY AND COMPANY (US) 1987-01-13 — — US disclosed
US-4537889-A PHENYL SUBSTITUTED IMIDAZO COMPOUNDS ELI LILLY AND COMPANY (US) 1985-08-27 — — US disclosed
EP-0113236-A1 Substituted imidazopyrimidines-pyrazines, and -triazines ELI LILLY AND COMPANY (US) 1984-07-11 — — EP 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-20190177327-A1 SUBSTITUTED METHYL PYRAZOLOPYRIMIDINONE AND METHYL IMIDAZOPYRAZINONE COMPOUNDS AS PDE1 INHIBITORS PDE3A, PDE5A, PDE4A MAOB 1062/4885NR4A1 251/4885NR4A2 320/4885

“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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