SCHEMBL6283575

SCHEMBL6283575

c1ccc2c(c1)C1CC1C1CC21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 10/20 0.41
KDM1B Q8NB78 2/20 0.41
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
MAOB P27338 8/20 0.36
MAOA P21397 7/20 0.36
CYP2C19 P33261 4/20 0.36
CYP2B6 P20813 3/20 0.36
HTR2C P28335 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
LMNA P02545 2/20 0.36
TAAR1 Q96RJ0 2/20 0.36
CYP3A4 P08684 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CYP2A6 P11509 1/20 0.36
SLC6A2 P23975 1/20 0.36
ADRA1A P35348 1/20 0.36

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
Ammonia Solution, Strong SCHEMBL4028071 0.71 MEN1 (0.41) KDM1AKDM1BCHRNB4CHRNA3HTR2C
Ammonia Solution, Strong SCHEMBL3952657 0.71 MEN1 (0.41) KDM1AKDM1BCHRNB4CHRNA3HTR2C
SCHEMBL3038872 0.71 CA2 (0.46) KDM1AKDM1BCHRNB4CHRNA3MAOB
SCHEMBL14668118 0.71 CA2 (0.46) KDM1AKDM1BCHRNB4CHRNA3MAOB
SCHEMBL12405329 0.71 KDM1A (0.41) KDM1AKDM1BCHRNB4CHRNA3MAOB
SCHEMBL24278585 0.71 CA2 (0.46) KDM1AKDM1BCHRNB4CHRNA3MAOB
SCHEMBL11803313 0.71 KDM1A (0.48) KDM1AKDM1BMAOBMAOACYP2C19
SCHEMBL1977397 0.71 CA2 (0.46) KDM1AKDM1BCHRNB4CHRNA3MAOB
SCHEMBL1802723 0.70 CYP3A4 (0.35) KDM1AKDM1BHTR2CCYP3A4HTR2B
SCHEMBL1801330 0.70 KDM1A (0.55) KDM1AHTR2CCYP2D6CYP2C9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6936672-B2 Mold addition polymerization of norbornene-type monomers using group 10 metal complexes SUMITOMO BAKELITE CO., LTD. (JP) 2005-08-30 US disclosed
US-20030120006-A1 In mold addition polymerization of norbornene-type monomers using group 10 metal complexes THE B.F. GOODRICH COMPANY 2003-06-26 US disclosed
US-6350832-B1 CATALYTIC COSSLINKING POLYMER OF POLYCYCLOOLEFIN MONOMER, MOLDING AND SHAPING IN THE PRESENCE OF GROUP 10 TRANSITION METAL AND ANION THE B. F. GOODRICH COMPANY 2002-02-26 US disclosed
EP-1155057-A1 IN MOLD ADDITION POLYMERIZATION OF NORBORNENE-TYPE MONOMERS USING GROUP 10 METAL COMPLEXES The B.F.Goodrich Co. (US) 2001-11-21 EP disclosed
WO-2000034344-A1 IN MOLD ADDITION POLYMERIZATION OF NORBORNENE-TYPE MONOMERS USING GROUP 10 METAL COMPLEXES THE B.F.GOODRICH COMPANY (US) 2000-06-15 WO disclosed