SCHEMBL8802227

SCHEMBL8802227

Nc1oc2ccccc2c(=O)c1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.59
▸ CYP3A4 P08684 6/20 0.59
▸ MEN1 O00255 6/20 0.59
▸ KMT2A Q03164 6/20 0.59
▸ MAPK1 P28482 4/20 0.59
▸ CA1 P00915 3/20 0.59
▸ CA2 P00918 3/20 0.59
▸ ALOX15 P16050 3/20 0.59
▸ TP53 P04637 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ CA12 O43570 1/20 0.59
▸ ABCB1 P08183 1/20 0.59
▸ CALM1 P0DP23 1/20 0.59
▸ AR P10275 1/20 0.59
▸ PKM P14618 1/20 0.59
▸ CYP1B1 Q16678 1/20 0.59
▸ CA9 Q16790 1/20 0.59
▸ THRB P10828 1/20 0.59
▸ HSD17B10 Q99714 5/20 0.57
▸ MAOA P21397 5/20 0.57

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
SCHEMBL28961807 0.84 KDM4E (0.50) KDM4ECYP3A4MEN1KMT2AMAPK1
SCHEMBL1180659 0.80 KDM4E (0.62) KDM4ECYP3A4MEN1KMT2AMAPK1
SCHEMBL16586869 0.78 NMUR2 (0.68) KDM4ECYP3A4MEN1KMT2AMAPK1
SCHEMBL4757017 0.77 LMNA (0.61) KDM4ECYP3A4MEN1KMT2AMAPK1
SCHEMBL29253103 0.77 KDM4E (0.59) KDM4ECYP3A4MEN1KMT2ACA1
SCHEMBL11777344 0.77 CA1 (0.54) KDM4ECYP3A4CA1CA2THRB
SCHEMBL17353579 0.76 MEN1 (0.77) KDM4ECYP3A4MEN1KMT2AMAPK1
SCHEMBL2746872 0.76 MEN1 (0.90) KDM4ECYP3A4MEN1KMT2AMAPK1
SCHEMBL8752341 0.75 CA12 (0.55) KDM4ECYP3A4CA1CA2CA12
SCHEMBL4261482 0.74 CA1 (1.00) KDM4ECYP3A4MEN1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5703075-A Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones PHARMACIA & UPJOHN COMPANY (US) 1997-12-30 — — US disclosed
EP-0525123-B1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES UPJOHN CO (US) 1997-09-17 — — EP disclosed
EP-0525123-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES. UPJOHN CO (US) 1993-02-03 — — EP disclosed
WO-1991019707-A2 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1991-12-26 — — WO disclosed
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