SCHEMBL7286156

SCHEMBL7286156

COCCNc1nc(-c2cccnc2)nc2ccc(C(C)=O)cc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 4/20 0.58
▸ CYP3A4 P08684 4/20 0.58
▸ CLK4 Q9HAZ1 3/20 0.58
▸ TSHR P16473 2/20 0.58
▸ GBA1 P04062 8/20 0.55
▸ ALDH1A1 P00352 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ HIF1A Q16665 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ GAA P10253 1/20 0.54
▸ PKM P14618 1/20 0.54
▸ HPGD P15428 1/20 0.53
▸ ALOX15 P16050 2/20 0.52
▸ USP2 O75604 1/20 0.52
▸ TP53 P04637 1/20 0.52
▸ APEX1 P27695 1/20 0.52
▸ CASP7 P55210 1/20 0.52

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
SCHEMBL14727594 0.85 GBA1 (0.59) CYP1A2CYP3A4CLK4TSHRGBA1
SCHEMBL7611890 0.83 ALDH1A1 (0.55) CYP1A2CYP3A4CLK4TSHRGBA1
SCHEMBL7280290 0.82 GBA1 (0.58) CYP1A2CYP3A4CLK4TSHRGBA1
SCHEMBL16183747 0.81 CYP1A2 (0.61) CYP1A2CYP3A4CLK4TSHRGBA1
SCHEMBL7609072 0.81 ALDH1A1 (0.58) CYP1A2CYP3A4CLK4TSHRGBA1
SCHEMBL17212398 0.80 GBA1 (0.61) GBA1ALDH1A1LMNAMEN1KMT2A
SCHEMBL7609160 0.79 CYP1A2 (0.55) CYP1A2CYP3A4CLK4TSHRGBA1
SCHEMBL16183486 0.79 BRAF (0.59) CYP1A2CYP3A4CLK4TSHRALDH1A1
SCHEMBL20273688 0.79 GBA1 (0.60) CYP1A2CYP3A4CLK4GBA1ALDH1A1
SCHEMBL14727599 0.78 PDE5A (0.57) CYP1A2CYP3A4CLK4TSHRGBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 — — EP claimed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 — — EP claimed
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 — — EP disclosed
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