Naphthalene

Naphthalene

SCHEMBL27735937

C=C(c1ccccc1)c1ccccc1.c1c[nH]nn1.c1ccc2ccccc2c1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ CHEK1 O14757 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ MAPT P10636 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL27916776 0.95 MEN1 (0.40) MEN1KMT2ACHEK1KDRMAPT
Naphthalene SCHEMBL4047989 0.83 CYP2A6 (0.40) MEN1KMT2AMAPT
Naphthalene SCHEMBL28993985 0.83 CYP2A6 (0.40) MEN1KMT2AMAPT
Naphthalene SCHEMBL28007049 0.81 CYP2A6 (0.38) —
Naphthalene SCHEMBL28178058 0.80 CA12 (0.42) MEN1KMT2AMAPTTDP1
SCHEMBL27970673 0.80 KMT2A (0.33) MEN1KMT2A
SCHEMBL28061261 0.80 KMT2A (0.33) MEN1KMT2A
SCHEMBL28016232 0.78 MEN1 (0.32) MEN1KMT2A
Terephthalic Acid SCHEMBL27990425 0.78 TSHR (0.42) MEN1KMT2AKDR
Naphthalene SCHEMBL27921575 0.77 MEN1 (0.54) MEN1KMT2AMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102108320-A Mouldproof liquid detergent BEIJING DAILY CHEMICALS CO LTD 2011-06-29 — — CN claimed
CN-101372648-A Low foam laundry liquid BEIJING LUOWA DAILY CHEMICAL C (CN) 2009-02-25 — — CN claimed
CN-102108320-A Mouldproof liquid detergent BEIJING DAILY CHEMICALS CO LTD 2011-06-29 — — CN disclosed
CN-101372648-B Low foam laundry liquid BEIJING LUOWA DAILY CHEMICAL CO LTD 2010-10-27 — — CN disclosed
CN-101372648-A Low foam laundry liquid BEIJING LUOWA DAILY CHEMICAL C (CN) 2009-02-25 — — CN disclosed
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