Naphthalene

Naphthalene

SCHEMBL9738334

Clc1ccc2nc[nH]c2c1Cl.c1ccc2c(c1)ccc1[nH]cnc12.c1ccc2ccccc2c1

nearest known ligand 0.44

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.44
CYP2A6 P11509 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 3/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PRNP P04156 1/20 0.37
HTT P42858 1/20 0.37
QPCT Q16769 1/20 0.34
AURKA O14965 1/20 0.34
DAPK3 O43293 1/20 0.34
JAK2 O60674 1/20 0.34
PRKD3 O94806 1/20 0.34
MAP4K4 O95819 1/20 0.34
PAK4 O96013 1/20 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
SCHEMBL9738912 0.99 LMNA (0.45) LMNAMEN1KMT2APOLBCYP2A6
Naphthalene SCHEMBL9683208 0.81 LMNA (0.59) LMNAMEN1KMT2APOLBCYP2A6
Naphthalene SCHEMBL9738509 0.80 LMNA (0.44) LMNAMEN1KMT2APOLBCYP2A6
SCHEMBL51008 0.79 LMNA (0.61) LMNAMEN1KMT2APOLBCYP2A6
SCHEMBL7865073 0.79 LMNA (0.48) LMNAMEN1KMT2APOLBNPC1
SCHEMBL9739024 0.79 LMNA (0.45) LMNAMEN1KMT2APOLBCYP2A6
Naphthalene SCHEMBL9739118 0.78 LMNA (0.50) LMNAMEN1KMT2APOLBNPC1
Bromide SCHEMBL27972711 0.78 LMNA (0.59) LMNAMEN1KMT2APOLBCYP2A6
SCHEMBL30330977 0.78 LMNA (0.59) LMNAMEN1KMT2APOLBCYP2A6
Benzimidazole SCHEMBL8417549 0.77 LMNA (0.51) LMNAMEN1KMT2APOLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5139909-A Unsymmetrical XEROX CORPORATION (US) 1992-08-18 US disclosed