SCHEMBL15382004

SCHEMBL15382004

CCCCc1nn(-c2cc(-n3nc(CCCC)c(/N=N/c4c(C(=O)OC)c(-c5ccccn5)nn4C)c3N)ncn2)c(N)c1/N=N/c1c(C(=O)OC)c(-c2ccccn2)nn1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ GRK6 P43250 2/20 0.33
▸ ATM Q13315 4/20 0.33
▸ GABRG2 P18507 1/20 0.31
▸ GABRB3 P28472 1/20 0.31
▸ GABRA3 P34903 1/20 0.31
▸ KDM5A P29375 1/20 0.31
▸ KDM4C Q9H3R0 1/20 0.31
▸ KDM5B Q9UGL1 1/20 0.31
▸ SLC34A1 Q06495 3/20 0.31
▸ RET P07949 1/20 0.31
▸ KLK3 P07288 1/20 0.31
▸ TP53 P04637 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C19 P33261 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
SCHEMBL14845513 0.90 TP53 (0.39) NPC1RAB9AALDH1A1GRK6GABRG2
SCHEMBL10454081 0.86 MAPT (0.41) NPC1RAB9AALDH1A1ATMGABRG2
SCHEMBL9974642 0.86 TP53 (0.36) NPC1RAB9AALDH1A1GRK6GABRG2
SCHEMBL14845512 0.85 SLC34A1 (0.34) NPC1RAB9AALDH1A1GRK6KDM5A
SCHEMBL9972781 0.83 MAPT (0.37) NPC1RAB9AALDH1A1GABRG2GABRB3
SCHEMBL14845525 0.83 GABRP (0.35) NPC1RAB9AALDH1A1GRK6GABRG2
SCHEMBL13159971 0.82 MAPT (0.38) NPC1RAB9AALDH1A1ATMGABRG2
SCHEMBL10332095 0.82 SLC34A1 (0.35) SLC34A1TP53MAPTCYP1A2CYP2C19
SCHEMBL10167889 0.81 SLC34A1 (0.32) SLC34A1HPGD
SCHEMBL16063431 0.80 NPC1 (0.47) NPC1RAB9AALDH1A1KDM5AKDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835531-B2 Water-based ink composition for inkjet recording FUJIFILM CORPORATION (JP) 2014-09-16 — — US 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-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-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-20110050789-A1 INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-03 — — US disclosed
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