SCHEMBL29586502

SCHEMBL29586502

CC(CC(C)C)=NNC(=O)c1ccc2ccccc2c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ TP53 P04637 1/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ BRCA1 P38398 1/20 0.54
▸ HBB P68871 1/20 0.54
▸ HIF1A Q16665 1/20 0.54
▸ RAB9A P51151 2/20 0.50
▸ KMT2A Q03164 7/20 0.48
▸ MEN1 O00255 6/20 0.48
▸ KDM4A O75164 1/20 0.48
▸ CTDSP1 Q9GZU7 1/20 0.48
▸ KDM4C Q9H3R0 1/20 0.48
▸ GAA P10253 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ HTT P42858 1/20 0.47

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
SCHEMBL2276914 1.00 SMN1; SMN2 (0.54) SMN1; SMN2TP53CYP1A2CYP3A4CYP2C9
SCHEMBL5705734 1.00 SMN1; SMN2 (0.54) SMN1; SMN2TP53CYP1A2CYP3A4CYP2C9
SCHEMBL2276912 1.00 SMN1; SMN2 (0.54) SMN1; SMN2TP53CYP1A2CYP3A4CYP2C9
SCHEMBL2282341 0.88 TP53 (0.52) SMN1; SMN2TP53CYP1A2CYP3A4CYP2C9
SCHEMBL6633882 0.87 KMT2A (0.56) SMN1; SMN2RAB9AKMT2AMEN1GAA
SCHEMBL1563655 0.87 KMT2A (0.56) SMN1; SMN2RAB9AKMT2AMEN1GAA
SCHEMBL1563654 0.87 KMT2A (0.56) SMN1; SMN2RAB9AKMT2AMEN1GAA
SCHEMBL2276263 0.85 SMN1; SMN2 (0.57) SMN1; SMN2TP53CYP1A2CYP3A4CYP2C9
SCHEMBL6638592 0.85 SMN1; SMN2 (0.57) SMN1; SMN2TP53CYP1A2CYP3A4CYP2C9
SCHEMBL2276266 0.85 SMN1; SMN2 (0.57) SMN1; SMN2TP53CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114521202-B Rubber composition, method for producing same, and tire for engineering vehicle 横滨橡胶株式会社 2024-01-26 — — CN disclosed
CN-111094428-B Rubber composition 住友化学株式会社 2022-07-15 — — CN disclosed
CN-114521202-A Rubber composition, method for producing same, and tire for construction vehicle 横滨橡胶株式会社 2022-05-20 — — CN disclosed
WO-2022097606-A1 RUBBER COMPOSITION FOR TIRES 横浜ゴム株式会社 2022-05-12 — — WO disclosed
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