SCHEMBL10957654

SCHEMBL10957654

COc1cccc(-n2c(=O)[nH]c3ccc(OC)c(OC)c3c2=O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ HPGD P15428 3/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ HIF1A Q16665 1/20 0.51
▸ NTRK1 P04629 5/20 0.50
▸ NTRK2 Q16620 5/20 0.50
▸ IGF1R P08069 4/20 0.50
▸ FGFR1 P11362 4/20 0.50
▸ HSD17B10 Q99714 2/20 0.49
▸ KMT2A Q03164 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ LMNA P02545 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ RECQL P46063 1/20 0.42

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
SCHEMBL6979777 0.76 KDM4E (0.68) KDM4EALDH1A1HPGDSMN1; SMN2HIF1A
SCHEMBL10957578 0.74 ADORA3 (0.42) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL8321111 0.72 CYP1A2 (0.65) KDM4EALDH1A1SMN1; SMN2NTRK1NTRK2
SCHEMBL10957936 0.71 CYP1A2 (0.47) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL30743937 0.71 NTRK1 (0.91) KDM4EALDH1A1HPGDNTRK1NTRK2
SCHEMBL21295418 0.71 NTRK1 (0.91) KDM4EALDH1A1HPGDNTRK1NTRK2
SCHEMBL10956542 0.70 ALDH1A1 (0.53) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL10750340 0.69 PDE3B (0.39) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL5126580 0.69 KDM4E (0.52) KDM4EALDH1A1HPGDSMN1; SMN2HIF1A
SCHEMBL3030044 0.69 CYP1A2 (0.64) ALDH1A1SMN1; SMN2NTRK1NTRK2IGF1R

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
EP-0176333-A2 Substituted quinazolinediones ORTHO PHARMACEUTICAL CORPORATION (US) 1986-04-02 — — EP disclosed
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