SCHEMBL5060770

SCHEMBL5060770

CCOC(=O)Cc1nn(CN2C(=O)c3c(Cl)c(Cl)c(Cl)c(Cl)c3C2=O)c(=O)c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.67
▸ ALDH1A1 P00352 2/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ GAA P10253 2/20 0.50
▸ AKT1 P31749 1/20 0.50
▸ CNKSR1 Q969H4 1/20 0.50
▸ SLC6A4 P31645 8/20 0.49
▸ HTR2A P28223 4/20 0.49
▸ HTR2C P28335 3/20 0.49
▸ MAPT P10636 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ LMNA P02545 1/20 0.46

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
SCHEMBL5014224 0.80 RECQL (0.83) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL9197789 0.79 RECQL (0.81) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL5009469 0.79 RECQL (0.81) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL9374155 0.76 RECQL (0.76) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL15597475 0.75 SMN1; SMN2 (1.00) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL13720543 0.74 SMN1; SMN2 (0.74) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL9207026 0.73 ALDH1A1 (0.67) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL11170511 0.73 ALDH1A1 (0.67) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL11170337 0.73 ALDH1A1 (0.74) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2
SCHEMBL9200706 0.72 AKR1B1 (0.73) RECQLALDH1A1SMN1; SMN2L3MBTL1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008093920-A2 1,2-DIHYDRO-1-OXOPHTHALAZINYL DERIVATIVES HAVING BIOLOGICAL ACTIVITY ON SEROTONIN RECEPTORS 5-HT2A AND 5-HT2C, AND PREPARATION THEREOF DONGBU HITEK CO., LTD. (KR) 2008-08-07 — — WO disclosed
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