SCHEMBL17417874

SCHEMBL17417874

C=CCn1c2ccc([N+](=O)[O-])cc2c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ POLB P06746 2/20 0.54
▸ ATM Q13315 1/20 0.54
▸ APOBEC3G Q9HC16 2/20 0.46
▸ CFTR P13569 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ IRAK4 Q9NWZ3 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.42
▸ DHFR P00374 1/20 0.40
▸ PLA2G2A P14555 1/20 0.40

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
SCHEMBL6139257 0.93 MAPT (0.68) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL11651352 0.78 MAPT (0.53) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL29539965 0.78 MAPT (0.85) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL148001 0.78 MAPT (0.85) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL7963373 0.78 MAPT (0.64) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL11163440 0.78 CFTR (0.54) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL3650932 0.77 PARP1 (0.40) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL5464933 0.77 CNR2 (0.46) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL622609 0.76 CFTR (0.50) MAPTMEN1KMT2ALMNAPOLB
SCHEMBL30013273 0.75 MAPT (0.66) MAPTMEN1KMT2ALMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10545387-B2 Electrochromic device for applying voltage to electrodes CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2020-01-28 — — US claimed
US-20160011482-A1 ELECTROCHROMIC DEVICE COMPRISING THREE OR FOUR LAYERS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-01-14 — — US claimed
US-10545387-B2 Electrochromic device for applying voltage to electrodes CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2020-01-28 — — US disclosed
US-20160011482-A1 ELECTROCHROMIC DEVICE COMPRISING THREE OR FOUR LAYERS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-01-14 — — US disclosed
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