Naphthalene

Naphthalene

SCHEMBL28217536

C=O.O=P(O)(O)O.c1ccc2ccccc2c1

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Naphthalene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.50
ALOX12 P18054 1/20 0.50
CA2 P00918 2/20 0.46
CA4 P22748 1/20 0.46
CA5A P35218 1/20 0.46
PTPN1 P18031 3/20 0.45
PTK2B Q14289 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
ACP3 P15309 1/20 0.41
SRC P12931 2/20 0.40
CFTR P13569 1/20 0.40
PGK1 P00558 1/20 0.39
PGK2 P07205 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
CA12 O43570 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38

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
Naphthalene SCHEMBL3796240 0.94 CYP2A6 (0.57) CYP2A6ALOX12CA2CA4CA5A
Naphthalene SCHEMBL19062554 0.94 CYP2A6 (0.57) CYP2A6ALOX12CA2CA4CA5A
Naphthalene SCHEMBL30423233 0.94 CYP2A6 (0.57) CYP2A6ALOX12CA2CA4CA5A
Naphthalene SCHEMBL30445823 0.94 CYP2A6 (0.57) CYP2A6ALOX12CA2CA4CA5A
Naphthalene SCHEMBL1680172 0.94 CYP2A6 (0.57) CYP2A6ALOX12CA2CA4CA5A
Naphthalene SCHEMBL28848051 0.90 CYP2A6 (0.53) CYP2A6ALOX12CA2CA4CA5A
Naphthalene SCHEMBL28905256 0.88 CYP2A6 (0.50) CYP2A6ALOX12CA2CA4CA5A
Naphthalene SCHEMBL194159 0.83 CYP2A6 (0.73) CYP2A6ALOX12CA2L3MBTL1ALOX15
Naphthalene SCHEMBL8366099 0.83 CYP2A6 (0.73) CYP2A6ALOX12CA2L3MBTL1ALOX15
Anthracene SCHEMBL27692909 0.82 PTPN1 (0.47) ALOX12CA2CA4CA5APTPN1

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-108219648-A A kind of T8 straight tubes diffusion powder coating and its preparation process 浙江江山三友电子有限公司 2018-06-29 CN claimed
CN-213699611-U Water-reducing agent anti-caking agitating unit 河北方霖环保科技有限公司 2021-07-16 CN disclosed
CN-108219648-A A kind of T8 straight tubes diffusion powder coating and its preparation process 浙江江山三友电子有限公司 2018-06-29 CN disclosed