SCHEMBL9579247

SCHEMBL9579247

CCCCCC1=NCCCO1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL29733212 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL29733245 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL29117559 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL29117560 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL9743377 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL10382163 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL29733165 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL9743005 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL31115193 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A
SCHEMBL29117640 0.98 NOS3 (0.36) NOS3NOS1NOS2MEN1KMT2A

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
WO-1992011243-A1 1-MONO OR 1,3-BIS-SUBSTITUTED IMIDAZOLIUM SALTS AND THEIR BENZO ANALOGUES, PROCESS FOR MANUFACTURE AND THEIR USE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1992-07-09 WO claimed
EP-4267708-A1 THERMALLY RESPONSIVE BRUSH POLYMERS HAVING A COPOLYMER BACKBONE AND COPOLYMER ARMS Infineum International Limited (GB) 2023-11-01 EP disclosed
CN-116981758-A Thermally responsive brush polymers having a copolymer backbone and copolymer arms 英菲诺姆国际有限公司 2023-10-31 CN disclosed
WO-2022136384-A1 THERMALLY RESPONSIVE BRUSH POLYMERS HAVING A COPOLYMER BACKBONE AND COPOLYMER ARMS INFINEUM INTERNATIONAL LIMITED (GB) 2022-06-30 WO disclosed
US-5252407-A Containing cyclic iminoether compound TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-12 US disclosed
EP-0335980-B1 RUBBER COMPOSITE Takeda Chemical Industries, Ltd. (JP) 1993-01-27 EP disclosed
WO-1992011243-A1 1-MONO OR 1,3-BIS-SUBSTITUTED IMIDAZOLIUM SALTS AND THEIR BENZO ANALOGUES, PROCESS FOR MANUFACTURE AND THEIR USE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1992-07-09 WO disclosed
EP-0335980-A1 RUBBER COMPOSITE Takeda Chemical Industries, Ltd. (JP) 1989-10-11 EP disclosed