SCHEMBL12759170

SCHEMBL12759170

COC(=O)c1cnn(C)c1/N=N/c1c(C)nn(-c2ccc(-n3nc(C)c(/N=N/c4c(C(=O)CO)cnn4C)c3N)nn2)c1C

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.34
▸ NPC1 O15118 6/20 0.34
▸ RAB9A P51151 5/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ KMT2A Q03164 4/20 0.33
▸ LMNA P02545 4/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ TDP1 Q9NUW8 2/20 0.32
▸ TP53 P04637 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ SPR P35270 2/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ ATM Q13315 1/20 0.30

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
SCHEMBL9972782 0.97 MAPT (0.36) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL10452732 0.90 KMT2A (0.39) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL4068359 0.87 NPC1 (0.42) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL9972776 0.87 NPC1 (0.42) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL15159235 0.86 MAPT (0.31) MAPTNPC1RAB9ASMN1; SMN2LMNA
SCHEMBL9972789 0.86 NPC1 (0.34) MAPTNPC1RAB9AKMT2ALMNA
SCHEMBL12759198 0.86 NPC1 (0.34) MAPTNPC1RAB9AKMT2ALMNA
SCHEMBL10331433 0.86 KMT2A (0.38) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL9972795 0.85 NPC1 (0.32) MAPTNPC1RAB9AKMT2ACYP1A2
SCHEMBL9972786 0.84 NPC1 (0.33) MAPTNPC1RAB9ASMN1; SMN2KMT2A

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-8393725-B2 Ink set and image forming method FUJIFILM CORPORATION (JP) 2013-03-12 — — US disclosed
US-20110050789-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
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