SCHEMBL10453828

SCHEMBL10453828

COC(=O)c1cnn(C)c1/N=N/c1c(C)nn(-c2cc(-n3nc(C)c(/N=N/c4c(C(=O)OC)cnn4C)c3N)ncn2)c1N

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.46
▸ RAB9A P51151 6/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ MAPT P10636 9/20 0.46
▸ LMNA P02545 3/20 0.46
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ RECQL P46063 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ HPGD P15428 3/20 0.34
▸ SPR P35270 1/20 0.33
▸ TDP1 Q9NUW8 3/20 0.33
▸ ATM Q13315 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ SLC34A1 Q06495 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
SCHEMBL9972811 0.96 NPC1 (0.43) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL4068359 0.94 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL9972776 0.94 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10454267 0.94 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10453754 0.94 NPC1 (0.42) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL13131240 0.92 NPC1 (0.37) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10454090 0.90 NPC1 (0.50) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10454085 0.89 NPC1 (0.38) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL10454072 0.89 KMT2A (0.37) NPC1RAB9AALDH1A1MAPTLMNA
SCHEMBL16328858 0.89 KMT2A (0.37) NPC1RAB9AALDH1A1MAPTLMNA

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154209-B1 Water-based ink composition for inkjet recording FUJIFILM CORP (JP) 2014-12-31 — — EP disclosed
US-8835531-B2 Water-based ink composition for inkjet recording FUJIFILM CORPORATION (JP) 2014-09-16 — — US disclosed
US-8835531-B2 Water-based ink composition for inkjet recording FUJIFILM CORPORATION (JP) 2014-09-16 — — US disclosed
EP-2370530-B1 INK SET, RECORDED MATERIAL AND PRINTED MATERIAL FUJIFILM CORP (JP) 2014-02-12 — — EP disclosed
US-8641785-B2 Aqueous pigment dispersion and aqueous ink for inkjet recording FUJIFILM CORPORATION (JP) 2014-02-04 — — US disclosed
US-8580025-B2 Ink set, recording method, recorded material and printed material FUJIFILM CORPORATION (JP) 2013-11-12 — — US disclosed
US-8500897-B2 Ink set, recorded material and printed material FUJIFILM CORPORATION (JP) 2013-08-06 — — US disclosed
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-8426495-B2 Radiation-curable ink composition for inkjet recording, inkjet recording method, and printed matter FUJIFILM CORPORATION (JP) 2013-04-23 — — US disclosed
US-8415409-B2 Radiation-curable ink composition for inkjet recording, inkjet recording method, and printed matter FUJIFILM CORPORATION (JP) 2013-04-09 — — US disclosed
US-20110205289-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2011-08-25 — — US disclosed
US-20110050790-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
US-20110050790-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
US-20110050789-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
US-20110050784-A1 AQUEOUS INK COMPOSITION FOR INKJET RECORDING AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
US-20100240812-A1 OIL-BASED INKJET RECORDING INK FUJIFILM CORPORATION (JP) 2010-09-23 — — US disclosed
US-20100221506-A1 RADIATION-CURABLE INK COMPOSITION FOR INKJET RECORDING,INKJET RECORDING METHOD, AND PRINTED MATTER FUJIFILM CORPORATION (JP) 2010-09-02 — — 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-20100222472-A1 WATER-BASED INK COMPOSITION FOR INKJET RECORDING 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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