SCHEMBL12759172

SCHEMBL12759172

CCCCc1nn(-c2cnc(-n3nc(C)c(/N=N/c4c(C(=O)OC)cnn4C)c3N)cn2)c(N)c1/N=N/c1c(C(=O)C=O)cnn1C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL14845526 0.91 NPC1 (0.34) NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL9972788 0.91 MAPT (0.33) NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL9974617 0.86 NPC1 (0.32) NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL13131240 0.84 NPC1 (0.37) NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL10454267 0.84 NPC1 (0.42) NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL10456879 0.84 NPC1 (0.42) NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL14845527 0.83 NPC1 (0.36) NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL14765505 0.81 NPC1 (0.34) NPC1RAB9AMAPT
SCHEMBL13159973 0.81 KMT2A (0.33) NPC1RAB9AMAPT
SCHEMBL9974655 0.81 NPC1 (0.40) NPC1RAB9AMAPTSMN1; SMN2

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 4 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-8348408-B2 Ink set and image forming method FUJIFILM CORPORATION (JP) 2013-01-08 — — 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
Send feedback