SCHEMBL9876834

SCHEMBL9876834

CCCCCCCCCCN(CCCC)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.51
JAK2 O60674 1/20 0.51
RAB9A P51151 1/20 0.51
PAX8 Q06710 1/20 0.51
KCNH2 Q12809 1/20 0.49
CNR2 P34972 3/20 0.46
ICMT O60725 1/20 0.45
ALB P02768 1/20 0.45
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
GFER P55789 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TSHR P16473 1/20 0.44
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL25225974 1.00 NPC1 (0.51) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL5715744 1.00 NPC1 (0.51) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL10490562 1.00 NPC1 (0.51) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL2419505 1.00 NPC1 (0.51) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL9185996 1.00 NPC1 (0.51) NPC1JAK2RAB9APAX8KCNH2
Hydrochloric Acid SCHEMBL11650785 0.98 NPC1 (0.50) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL25224593 0.98 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL25270420 0.98 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL25227860 0.98 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2
SCHEMBL25226812 0.98 NPC1 (0.53) NPC1JAK2RAB9APAX8KCNH2

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
EP-4446310-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND Asahi Kasei Kabushiki Kaisha (JP) 2024-10-16 EP disclosed
CN-118382612-A Method for producing blocked isocyanate compound and method for producing isocyanate compound 旭化成株式会社 2024-07-23 CN disclosed
WO-2023106377-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND 旭化成株式会社 2023-06-15 WO disclosed
US-4981612-A AZO DYES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-01 US disclosed
US-4946629-A Optical element having non-linear optical properties including a substrate having a coating of an azo compound IMPERIAL CHEMICAL INDUSTRIES, PLC (GB) 1990-08-07 US disclosed
US-4804747-A NON-LINEAR OPTICAL ELEMENTS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-02-14 US disclosed
EP-0293093-A2 Azo Compound IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-11-30 EP disclosed
EP-0220042-A2 Azo compound IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-04-29 EP disclosed