SCHEMBL7915525

SCHEMBL7915525

c1ccc(C2CCC3CCC2CC3)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.50
SLC6A3 Q01959 2/20 0.47
MAOB P27338 10/20 0.44
MAOA P21397 8/20 0.44
KDM1A O60341 6/20 0.44
CYP2C19 P33261 4/20 0.44
CYP2B6 P20813 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C9 P11712 2/20 0.44
LMNA P02545 2/20 0.44
TAAR1 Q96RJ0 2/20 0.44
HTR2C P28335 2/20 0.44
CYP3A4 P08684 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CYP2A6 P11509 1/20 0.44
SLC6A2 P23975 1/20 0.44
ADRA1A P35348 1/20 0.44
DRD3 P35462 1/20 0.44

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
SCHEMBL10740313 0.84 SLC6A3 (0.50) CHRNA7SLC6A3MAOBMAOAKDM1A
SCHEMBL10740303 0.84 SLC6A3 (0.50) CHRNA7SLC6A3MAOBMAOAKDM1A
SCHEMBL2768025 0.79 MAOB (0.57) CHRNA7SLC6A3MAOBMAOAKDM1A
SCHEMBL2769401 0.79 MAOB (0.57) CHRNA7SLC6A3MAOBMAOAKDM1A
SCHEMBL2768026 0.79 MAOB (0.57) CHRNA7SLC6A3MAOBMAOAKDM1A
SCHEMBL6053773 0.77 SLC6A3 (0.57) CHRNA7SLC6A3MAOBMAOAKDM1A
SCHEMBL8673153 0.77 SLC6A3 (0.57) CHRNA7SLC6A3MAOBMAOAKDM1A
Ammonia Solution, Strong SCHEMBL11529212 0.76 MAOB (0.55) CHRNA7SLC6A3MAOBMAOAKDM1A
SCHEMBL7914873 0.74 SLC6A3 (0.46) SLC6A3MAOBMAOAKDM1ACYP2C19
SCHEMBL28843512 0.71 CHRNA7 (0.41) CHRNA7SLC6A3MAOBMAOAKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed