SCHEMBL11456047

SCHEMBL11456047

C=Cc1ncc(CC)cc1C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDXK O00764 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ NOS3 P29474 1/20 0.32
▸ NOS1 P29475 1/20 0.32
▸ NOS2 P35228 1/20 0.32
▸ BTK Q06187 1/20 0.30
▸ PARP1 P09874 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
SCHEMBL9171315 0.81 PDXK (0.34) PDXKKDM4EL3MBTL1PARP1
SCHEMBL7245034 0.75 NOS3 (0.46) PDXKNOS3NOS1NOS2
SCHEMBL28464701 0.73 PDXK (0.39) PDXKKDM4EL3MBTL1PARP1
SCHEMBL10310085 0.73 NOS3 (0.38) KDM4EL3MBTL1NOS3NOS1NOS2
SCHEMBL15991301 0.72 PDXK (0.43) PDXK
SCHEMBL18688147 0.72 RRM2 (0.37) PDXKKDM4ENOS3NOS1NOS2
SCHEMBL6183097 0.72 PDXK (0.36) PDXK
SCHEMBL19823644 0.72 AGBL2 (0.41) PDXK
SCHEMBL25759811 0.71 NOS3 (0.36) KDM4EL3MBTL1NOS3NOS1NOS2
SCHEMBL23280655 0.71 PRMT5 (0.34) PDXKNOS3NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4211824-A CONJUGATED DIENE-VINYL NITROGEN HETEROCYCLE INTERPOLYMER ADHESIVE HONNY CHEMICALS COMPANY, LTD. (JP) 1980-07-08 — — US claimed
US-4096009-A METAL DEPOSITION, VINYL PYRIDINE COPOLYMERS HONNY CHEMICALS COMPANY, LTD. (JA) 1978-06-20 — — US claimed
US-4049875-A Bonding rubber to ferrous metal through a deposit of copper and adhesive and laminate therefrom HONNY CHEMICALS COMPANY, LTD. (JA) 1977-09-20 — — US claimed
US-3998992-A DIENE INTERPOLYMER ADHESIVE HONNY CHEMICALS CO., LTD. (JA) 1976-12-21 — — US claimed
US-3993847-A RUBBER BONDED TO FERROUS METAL, INTERPOLYMER OF CONJUGATED DIENE AND HETEROCYCLIC NITROGEN BASE HONNY CHEMICALS COMPANY, LTD. (JA) 1976-11-23 — — US claimed
US-4211824-A CONJUGATED DIENE-VINYL NITROGEN HETEROCYCLE INTERPOLYMER ADHESIVE HONNY CHEMICALS COMPANY, LTD. (JP) 1980-07-08 — — US disclosed
US-4096009-A METAL DEPOSITION, VINYL PYRIDINE COPOLYMERS HONNY CHEMICALS COMPANY, LTD. (JA) 1978-06-20 — — US disclosed
US-4049875-A Bonding rubber to ferrous metal through a deposit of copper and adhesive and laminate therefrom HONNY CHEMICALS COMPANY, LTD. (JA) 1977-09-20 — — US disclosed
US-3998992-A DIENE INTERPOLYMER ADHESIVE HONNY CHEMICALS CO., LTD. (JA) 1976-12-21 — — US disclosed
US-3993847-A RUBBER BONDED TO FERROUS METAL, INTERPOLYMER OF CONJUGATED DIENE AND HETEROCYCLIC NITROGEN BASE HONNY CHEMICALS COMPANY, LTD. (JA) 1976-11-23 — — US disclosed
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