SCHEMBL28287460

SCHEMBL28287460

CC(=O)Nc1ccccc1N=Nc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.66
▸ NPC1 O15118 5/20 0.66
▸ HTT P42858 1/20 0.66
▸ RAB9A P51151 5/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ CHRM1 P11229 1/20 0.54
▸ HPGD P15428 3/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ NAPRT Q6XQN6 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ CASP3 P42574 1/20 0.45
▸ SENP8 Q96LD8 1/20 0.45
▸ SENP7 Q9BQF6 1/20 0.45
▸ SENP6 Q9GZR1 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45

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
SCHEMBL27973104 1.00 MAPT (0.66) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL4000024 0.84 CHRM1 (0.50) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL14621405 0.81 HPGD (0.49) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL30620152 0.81 MAPT (0.63) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL13219022 0.81 MAPT (0.59) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL5183351 0.79 TGM2 (0.50) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL30532455 0.79 NPC1 (0.56) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL29074600 0.79 NPC1 (0.56) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL28836945 0.78 MAPT (0.53) MAPTNPC1HTTRAB9ASMN1; SMN2
SCHEMBL38651149 0.78 ALDH1A1 (0.57) MAPTNPC1HTTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109574871-B Acetaminoazobenzene derivative and preparation and application thereof 上海交通大学 2022-01-04 — — CN claimed
CN-109574871-A A kind of acetylamino azobenzene derivative and its preparation and application 上海交通大学 2019-04-05 — — CN claimed
CN-109574871-B Acetaminoazobenzene derivative and preparation and application thereof 上海交通大学 2022-01-04 — — CN disclosed
CN-109574871-B Acetaminoazobenzene derivative and preparation and application thereof 上海交通大学 2022-01-04 — — CN disclosed
CN-109574871-A A kind of acetylamino azobenzene derivative and its preparation and application 上海交通大学 2019-04-05 — — CN disclosed
CN-109574871-A A kind of acetylamino azobenzene derivative and its preparation and application 上海交通大学 2019-04-05 — — CN disclosed
CN-109574871-A A kind of acetylamino azobenzene derivative and its preparation and application 上海交通大学 2019-04-05 — — CN disclosed
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