SCHEMBL28639510

SCHEMBL28639510

CCCCCCC(=NOC(C)=O)C(=O)c1ccc(Sc2ccc(C=CC(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TUBB4A P04350 2/20 0.48
▸ TUBB P07437 2/20 0.48
▸ TUBA3C P0DPH7 2/20 0.48
▸ TUBA1B P68363 2/20 0.48
▸ TUBA4A P68366 2/20 0.48
▸ TUBB4B P68371 2/20 0.48
▸ TUBB3 Q13509 2/20 0.48
▸ TUBB2A Q13885 2/20 0.48
▸ TUBB8 Q3ZCM7 2/20 0.48
▸ TUBA3E Q6PEY2 2/20 0.48
▸ TUBA1A Q71U36 2/20 0.48
▸ TUBA1C Q9BQE3 2/20 0.48
▸ TUBB6 Q9BUF5 2/20 0.48
▸ TUBB2B Q9BVA1 2/20 0.48
▸ TUBB1 Q9H4B7 2/20 0.48
▸ MAOB P27338 2/20 0.43
▸ MAPT P10636 4/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL28972023 0.96 MAOB (0.44) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28639524 0.93 TUBB4A (0.48) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28641953 0.91 F3 (0.48) MAOBMAPTKMT2ANPC1RAB9A
SCHEMBL28657972 0.89 TUBB4A (0.39) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28644872 0.88 MAOB (0.50) MAOBMAPTKMT2ANPC1RAB9A
SCHEMBL13925199 0.87 CES2 (0.39) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL91994 0.87 CES2 (0.46) KMT2APOLBCES2CES1ALDH1A1
SCHEMBL16279116 0.87 CES2 (0.46) KMT2APOLBCES2CES1ALDH1A1
SCHEMBL16279115 0.87 CES2 (0.46) KMT2APOLBCES2CES1ALDH1A1
SCHEMBL28639513 0.87 MAPT (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113444017-B Diphenyl-sulfide-ether-ketone oxime ester compound, preparation method, composition and application 优禘股份有限公司 2022-05-13 — — CN disclosed
CN-113444017-A Diphenyl sulfide ether ketone oxime ester compound, preparation method, composition and application 优禘股份有限公司 2021-09-28 — — CN disclosed
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