SCHEMBL10332115

SCHEMBL10332115

Cn1ncc(C(=O)O)c1/N=N/c1c(-c2ccccc2)nn(-c2cc(-n3nc(-c4ccccc4)c(/N=N/c4c(C(=O)O)cnn4C)c3N)ncn2)c1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPT P10636 5/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ LMNA P02545 2/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ CSNK1D P48730 1/20 0.35
▸ SLC34A1 Q06495 3/20 0.33
▸ LDHA P00338 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ CSF1R P07333 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ FLT1 P17948 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ CSNK1A1 P48729 1/20 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
SCHEMBL10453845 0.91 NPC1 (0.51) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL9972780 0.85 NPC1 (0.46) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL13159981 0.85 NPC1 (0.46) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL10332107 0.85 MAPT (0.38) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL9972803 0.80 MAPK14 (0.42) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL10454078 0.79 NPC1 (0.47) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL10332091 0.79 GABRP (0.39) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL4068931 0.78 MAPT (0.34) NPC1RAB9AALDH1A1MAPTCYP1A2
SCHEMBL12506521 0.77 MAPT (0.56) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL13183216 0.77 MAPT (0.36) NPC1RAB9AALDH1A1MAPTCYP1A2

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
US-8222326-B2 Water-based ink composition for inkjet recording FUJIFILM CORPORATION (JP) 2012-07-17 — — US disclosed
US-8222410-B2 Azo pigments, and pigment dispersion, coloring composition and ink for inkjet recording containing the azo pigment FUJIFILM CORPORATION (JP) 2012-07-17 — — US disclosed
US-20110021763-A1 AZO PIGMENTS, AND PIGMENT DISPERSION, COLORING COMPOSITION AND INK FOR INKJET RECORDING CONTAINING THE AZO PIGMENT FUJIFILM CORPORATION (JP) 2011-01-27 — — 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
US-20100160504-A1 WATER-BASED INK COMPOSITION FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2010-06-24 — — US disclosed
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