SCHEMBL10485243

SCHEMBL10485243

C=CCn1[nH]c(=O)c2ccccc2c1=O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 1/20 0.57
▸ TSHR P16473 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.49
▸ KDM4E B2RXH2 3/20 0.49
▸ TP53 P04637 1/20 0.49
▸ CASP3 P42574 1/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ GAA P10253 3/20 0.43
▸ LMNA P02545 3/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ RIN1 Q13671 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
SCHEMBL1760473 0.83 ALOX5 (0.53) —
SCHEMBL30057865 0.83 MEN1 (0.43) GLSALDH1A1KDM4ETP53CASP3
SCHEMBL10484937 0.77 GLS (0.62) GLSTSHRALDH1A1KDM4ETP53
SCHEMBL10484833 0.74 GLS (0.68) GLSTSHRALDH1A1KDM4ETP53
SCHEMBL22633704 0.74 GLS (0.68) GLSTSHRALDH1A1KDM4ETP53
SCHEMBL12862597 0.72 GLS (0.57) GLSTSHRALDH1A1KDM4ETP53
SCHEMBL14884718 0.72 GLS (0.57) GLSTSHRALDH1A1KDM4ETP53
SCHEMBL4322902 0.71 GLS (0.64) GLSTSHRALDH1A1KDM4ETP53
SCHEMBL3002007 0.71 GLS (0.55) GLSTSHRALDH1A1KDM4ETP53
SCHEMBL30583194 0.71 GLS (0.64) GLSTSHRALDH1A1KDM4ETP53

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
US-4861778-A 2,3-dihydrophthalazine-1,4-diones RESEARCH CORPORATION (US) 1989-08-29 — — US disclosed
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