SCHEMBL13159982

SCHEMBL13159982

COC(=O)c1c(C)nn(C)c1/N=N/c1c(C)nn(-c2cc(-n3nc(C)c(/N=N/c4c(C(=O)C=O)c(C)nn4C)c3N)ncn2)c1N

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.38
▸ MAPT P10636 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ SLC34A1 Q06495 15/20 0.33

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
SCHEMBL10453830 0.95 HPGD (0.41) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL13159980 0.89 GABRP (0.35) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL9972778 0.89 HPGD (0.37) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL13159969 0.87 SLC34A1 (0.40) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL13159971 0.85 MAPT (0.38) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL10454069 0.85 GABRP (0.38) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL10454267 0.84 NPC1 (0.42) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL4068933 0.84 NPC1 (0.37) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL10454068 0.83 TP53 (0.44) HPGDMAPTNPC1ALDH1A1RAB9A
SCHEMBL14845512 0.82 SLC34A1 (0.34) HPGDMAPTNPC1ALDH1A1RAB9A

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-8426495-B2 Radiation-curable ink composition for inkjet recording, inkjet recording method, and printed matter FUJIFILM CORPORATION (JP) 2013-04-23 — — US disclosed
US-20100221507-A1 RADIATION-CURABLE INK COMPOSITION FOR INKJET RECORDING, INKJET RECORDING METHOD, AND PRINTED MATTER FUJIFILM CORPORATION (JP) 2010-09-02 — — US disclosed
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