SCHEMBL9972782

SCHEMBL9972782

COC(=O)c1cnn(C)c1/N=N/c1c(C)nn(-c2ccc(-n3nc(C)c(/N=N/c4c(C(=O)CO)cnn4C)c3N)nn2)c1N

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.36
▸ NPC1 O15118 8/20 0.36
▸ RAB9A P51151 8/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HPGD P15428 4/20 0.34
▸ TDP1 Q9NUW8 3/20 0.34
▸ TP53 P04637 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ ATM Q13315 1/20 0.32

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
SCHEMBL12759170 0.97 MAPT (0.34) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL10452732 0.93 KMT2A (0.39) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL9972776 0.90 NPC1 (0.42) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4068359 0.90 NPC1 (0.42) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL12759198 0.89 NPC1 (0.34) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL9972789 0.89 NPC1 (0.34) MAPTNPC1RAB9AALDH1A1KMT2A
SCHEMBL15159235 0.89 MAPT (0.31) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL10331433 0.89 KMT2A (0.38) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL9972795 0.88 NPC1 (0.32) MAPTNPC1RAB9AKMT2ACYP1A2
SCHEMBL9972786 0.87 NPC1 (0.33) MAPTNPC1RAB9ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-8399545-B2 Azo pigment-containing aqueous ink for inkjet recording FUJIFILM CORPORATION (JP) 2013-03-19 — — US disclosed
US-8348408-B2 Ink set and image forming method FUJIFILM CORPORATION (JP) 2013-01-08 — — US disclosed
US-8328344-B2 Aqueous ink composition for inkjet recording and image forming method FUJIFILM CORPORATION (JP) 2012-12-11 — — 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-20120165436-A1 PIGMENT DISPERSION CONTAINING AZO PIGMENT AND AQUEOUS INK FOR INKJET RECORDING USING THE SAME FUJIFILM CORPORATION (JP) 2012-06-28 — — US disclosed
US-20120165437-A1 AQUEOUS PIGMENT DISPERSION AND AQUEOUS INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2012-06-28 — — US disclosed
US-20120165438-A1 AQUEOUS PIGMENT DISPERSION AND AQUEOUS INK FOR INK JET RECORDING FUJIFILM CORPORATION (JP) 2012-06-28 — — US disclosed
US-20120156449-A1 INK SET, RECORDING METHOD, RECORDED MATERIAL AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-06-21 — — 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-20110166267-A1 AZO PIGMENT-CONTAINING AQUEOUS INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-07-07 — — US disclosed
US-20110050790-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-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
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