SCHEMBL7348992

SCHEMBL7348992

CCC(=O)c1ccc2c(c1)ONC(=O)C2

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.50
HPGD P15428 2/20 0.41
MAPT P10636 4/20 0.40
RXFP1 Q9HBX9 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SIGMAR1 Q99720 2/20 0.37
CTNNB1 P35222 4/20 0.37
WNT3A P56704 3/20 0.37
GAA P10253 1/20 0.36
EPHX2 P34913 1/20 0.36
TDP2 O95551 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL9437729 0.86 PTPN1 (0.40) HPGDMAPTTSHRALDH1A1CTNNB1
SCHEMBL7349547 0.84 MAPT (0.49) HPGDMAPTTDP2
Iodomethane SCHEMBL9706765 0.82 GSR (0.40) HPGD
SCHEMBL7491884 0.77 MMP2 (0.43) HPGDSMN1; SMN2TSHRTDP2PKM
SCHEMBL10691664 0.77 ALDH1A1 (0.50) ATMHPGDMAPTSMN1; SMN2L3MBTL1
SCHEMBL7343586 0.77 TDP2 (0.34) TSHRALDH1A1SIGMAR1TDP2PKM
SCHEMBL10691708 0.76 SRD5A2 (0.40) HPGDMAPTSMN1; SMN2ALDH1A1TDP2
SCHEMBL9590401 0.76 EGFR (0.36) ATMHPGDMAPTSMN1; SMN2TSHR
SCHEMBL7341862 0.75 TDP2 (0.33) TSHRTDP2PKM
SCHEMBL9588573 0.75 GAA (0.31) SMN1; SMN2GAATDP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5221742-A PROCESS FOR THE PREPARATION OF 6-(3,4-DIHYDRO-3-OXO-1,4(2H)-BENZOXAZIN-7-YL)-2,3,4,5-TETRAHYDROPYRIDAZIN-3-ONES ORTHO PHARMACEUTICAL CORPORATION (US) 1993-06-22 US disclosed
CN-1071427-A 6-Benzoxazinyl and 6-benzothiazine base-2,3,4,5-tetrahydro pyridazine-3-ketone ORTHO PHARMA CORP (US) 1993-04-28 CN disclosed
EP-0509845-A1 (+) and (-) enantiomers of 5-aliphatic-6-(benzoxazinyl- or benzothiazinyl)-2,3,4,5-tetrahydropyridazin-3-ones ORTHO PHARMACEUTICAL CORPORATION (US) 1992-10-21 EP disclosed
WO-1992011256-A1 PROCESS FOR THE PREPARATION OF BENZOXAZINYLTETRAHYDROPYRIDAZINES ORTHO PHARMACEUTICAL CORPORATION (US) 1992-07-09 WO disclosed
US-5081242-A Cardiotonic and bronchodilator agents; phosphodiesterase inhibitors ORTHO PHARMACEUTICAL CORPORATION (US) 1992-01-14 US disclosed
CN-87108354-A 6-benzoxazinyl and 6-benzothiazinyl-2, 3, 4, 5-tetrahydropyridazin-3-ones 1988-09-21 CN disclosed
US-4766118-A CARDIOTONIC AGENTS, PHOSPHODIESTERASE INHIBITORS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-08-23 US disclosed
EP-0272914-A2 6-Benzoxazinyl- and 6-benzothiazinyl-2,3,4,5-tetrahydropyridazin-3-ones ORTHO PHARMACEUTICAL CORPORATION (US) 1988-06-29 EP disclosed
US-4721784-A MUSCLE RELAXANTS, BRONCHODILATOR AGENTS, CARDIOTONIC AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-01-26 US disclosed