Naphthalene

Naphthalene

SCHEMBL27595244

C=C(C#N)C(=O)O.c1ccc2ccccc2c1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ MCL1 Q07820 3/20 0.36
▸ ALOX12 P18054 2/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ CES2 O00748 1/20 0.34
▸ CES1 P23141 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ XBP1 P17861 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ KMT2A Q03164 5/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ PKM P14618 2/20 0.34

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
Anthracene SCHEMBL11672672 0.92 KDM4E (0.39) CYP1A2CYP2C19CYP2C9MCL1ALOX12
Biphenyl SCHEMBL2200995 0.87 DHODH (0.41) CYP1A2CYP2C19CYP2C9MCL1ALDH1A1
Phenol SCHEMBL15224282 0.85 CA12 (0.46) CYP1A2CYP2C19CYP2C9MCL1CES2
Benzophenone SCHEMBL2536126 0.83 ALDH1A1 (0.56) ALDH1A1LMNAMAPTMAPK1RAB9A
Iodobenzene SCHEMBL27916168 0.83 TPMT (0.35) CYP1A2CYP2C19CYP2C9MCL1ALDH1A1
Benzoic Acid SCHEMBL8356613 0.83 TSHR (0.56) CYP2C9CES2CES1ALDH1A1LMNA
Aniline SCHEMBL28148485 0.83 TSHR (0.44) CYP1A2CYP2C19CYP2C9MCL1ALDH1A1
Indole SCHEMBL25431854 0.81 TRPA1 (0.53) CA1CA2ALDH1A1MAPTRAB9A
Benzofuran SCHEMBL27697568 0.81 CTNNB1 (0.39) CYP1A2CYP2C19CYP2C9CYP2A6CA1
SCHEMBL17385595 0.81 ALDH1A1 (0.53) CYP1A2CYP2C19CYP2C9CA1CA2

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
CN-113874459-B Flexible photocurable cyanoacrylate compositions 汉高股份有限及两合公司 2023-07-04 — — CN disclosed
CN-105246872-B Cyanoacrylate compositions 汉高知识产权控股有限责任公司 2019-08-13 — — CN disclosed
CN-1487983-A Cyanoacrylate compositions curable to flexible polymeric materials ���̩��(R&D)���޹�˾ 2004-04-07 — — CN disclosed
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