SCHEMBL9064565

SCHEMBL9064565

NC(=O)c1ccccn1.[Cu]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.64
▸ CES1 P23141 1/20 0.64
▸ L3MBTL1 Q9Y468 3/20 0.61
▸ LMNA P02545 3/20 0.61
▸ NAPRT Q6XQN6 1/20 0.61
▸ P4HTM Q9NXG6 1/20 0.61
▸ ALDH1A1 P00352 2/20 0.59
▸ KMT2A Q03164 1/20 0.55
▸ GSK3B P49841 1/20 0.53
▸ MAPK1 P28482 1/20 0.51
▸ NPC1 O15118 2/20 0.50
▸ PKM P14618 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ MITF O75030 1/20 0.50
▸ CDK5 Q00535 1/20 0.50
▸ CDK5R1 Q15078 1/20 0.50
▸ HDAC3 O15379 1/20 0.50
▸ HDAC4 P56524 1/20 0.50
▸ HDAC1 Q13547 1/20 0.50
▸ HDAC7 Q8WUI4 1/20 0.50

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
SCHEMBL1505348 0.98 — —
SCHEMBL4914089 0.98 CES2 (0.67) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL61183 0.98 — —
Ammonia Solution, Strong SCHEMBL902138 0.95 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL9094627 0.95 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
Hydrochloric Acid SCHEMBL17493405 0.95 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL31357681 0.95 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL16143265 0.95 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
Hydrochloric Acid SCHEMBL1704886 0.95 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT
SCHEMBL31286256 0.95 CES2 (0.64) CES2CES1L3MBTL1LMNANAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1139879-A Antimicrobial method and cosmetic composition OTSUKA PHARMA CO LTD (JP) 1997-01-08 — — CN claimed
EP-0728478-A1 ANTIMICROBIAL METHOD AND COSMETIC COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-08-28 — — EP claimed
CN-110467853-A A kind of environment-friendly type aqueous paint temporarily protected for cupric nonpolluting coating surface ZHONGHUAN HAIHUA XIAMEN SHIP INTELLIGENT PAINT CO LTD 2019-11-19 — — CN disclosed
CN-1139879-A Antimicrobial method and cosmetic composition OTSUKA PHARMA CO LTD (JP) 1997-01-08 — — CN disclosed
CN-1131900-A Polyester-packaged hinokitiol-containing composition OTSUKA PHARMA CO LTD (JP) 1996-09-25 — — CN disclosed
EP-0728478-A1 ANTIMICROBIAL METHOD AND COSMETIC COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-08-28 — — EP disclosed
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