1,8-Naphthalic Anhydride

1,8-Naphthalic Anhydride

SCHEMBL21046340

CNC.O=C1OC(=O)c2cccc3cccc1c23

nearest known ligand 0.83

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYMS P04818 8/20 0.83
ALDH1A1 P00352 6/20 0.54
CES2 O00748 1/20 0.54
BCHE P06276 1/20 0.54
CES1 P23141 1/20 0.54
MCL1 Q07820 1/20 0.54
PARP1 P09874 1/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALOX15 P16050 2/20 0.48
CYP3A4 P08684 1/20 0.47
PABPC1 P11940 1/20 0.47
DNMT1 P26358 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
HSD17B10 Q99714 4/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 3/20 0.46

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
1,8-Naphthalic Anhydride SCHEMBL29351054 0.91 TYMS (1.00) TYMSALDH1A1CES2BCHECES1
1,8-Naphthalic Anhydride SCHEMBL30415 0.91 TYMS (1.00) TYMSALDH1A1CES2BCHECES1
1,8-Naphthalic Anhydride SCHEMBL6929962 0.89 TYMS (0.95) TYMSALDH1A1CES2BCHECES1
1,8-Naphthalic Anhydride SCHEMBL11692800 0.89 TYMS (0.95) TYMSALDH1A1CES2BCHECES1
1,8-Naphthalic Anhydride SCHEMBL10012400 0.86 TYMS (0.91) TYMSALDH1A1CES2BCHECES1
1,8-Naphthalic Anhydride SCHEMBL10012771 0.83 TYMS (0.76) TYMSALDH1A1CES2BCHECES1
1,8-Naphthalic Anhydride SCHEMBL29143033 0.83 TYMS (0.83) TYMSALDH1A1CES2BCHECES1
Acenaphthoquinone SCHEMBL28157323 0.82 ALDH1A1 (0.81) TYMSALDH1A1CES2BCHECES1
SCHEMBL28272717 0.80 TYMS (0.58) TYMSALDH1A1CES2BCHECES1
1,8-Naphthalic Anhydride SCHEMBL7932111 0.79 TYMS (0.76) TYMSALDH1A1CES2BCHECES1

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
US-11884956-B2 Methods for detecting mycobacteria with solvatochromic dye conjugates THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2024-01-30 US disclosed
US-20190169671-A1 Methods for Detecting Mycobacteria with Solvatochromic Dye Conjugates THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2019-06-06 US disclosed