SCHEMBL16077935

SCHEMBL16077935

C/C(=N\c1c(C(C)C)cccc1C(C)C)c1ncnc(/C(C)=N/c2c(C(C)C)cccc2C(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRB2 P47870 2/20 0.37
LMNA P02545 2/20 0.37
FAAH O00519 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
GABRB1 P18505 1/20 0.37
PTGS1 P23219 1/20 0.37
SLC6A2 P23975 1/20 0.37
HTR2C P28335 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
HTR2B P41595 1/20 0.37
GABRA2 P47869 1/20 0.37

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
SCHEMBL5586905 1.00 GABRA1 (0.38) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL5587675 0.91 GABRA1 (0.34) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL5589300 0.83
SCHEMBL16077939 0.83 GABRA1 (0.36) GABRA1GABRB2
SCHEMBL16077922 0.83 SIGMAR1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL5589848 0.83 SIGMAR1 (0.43) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL5590403 0.82 GABRA1 (0.34) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL16077917 0.82 GABRA1 (0.34) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1002830 0.78 GABRA1 (0.41) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL16077932 0.78 GRIN2D (0.39) KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9695260-B2 Method for producing olefin block polymer using plurality of types of transition metal catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-04 US disclosed
US-9695260-B2 Method for producing olefin block polymer using plurality of types of transition metal catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-07-04 US disclosed
US-20140275429-A1 METHOD FOR PRODUCING OLEFIN BLOCK POLYMER USING PLURALITY OF TYPES OF TRANSITION METAL CATALYSTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-18 US disclosed