SCHEMBL9507129

SCHEMBL9507129

CCOC(C)(c1ccccc1C)c1ccccc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
TSHR P16473 3/20 0.36
ACHE P22303 2/20 0.36
NLRP3 Q96P20 1/20 0.35
CASR P41180 1/20 0.33
ALDH1A1 P00352 5/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 2/20 0.31
RAPGEF4 Q8WZA2 1/20 0.31
CHRM3 P20309 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
ESR1 P03372 1/20 0.30
DHODH Q02127 1/20 0.30
NR3C1 P04150 1/20 0.30
PGR P06401 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
SCHEMBL13450447 0.83 GABRA1 (0.36) GABRA1GABRB2TSHRACHENLRP3
SCHEMBL9504908 0.78 TSHR (0.43) GABRA1GABRB2TSHRACHECASR
SCHEMBL14163871 0.78 TSHR (0.35) GABRA1GABRB2TSHRACHENLRP3
SCHEMBL28820101 0.78 TSHR (0.35) GABRA1GABRB2TSHRACHENLRP3
SCHEMBL28092974 0.78 TSHR (0.35) GABRA1GABRB2TSHRACHENLRP3
SCHEMBL8101437 0.78 TSHR (0.35) GABRA1GABRB2TSHRACHENLRP3
SCHEMBL9504882 0.76 GABRA1 (0.45) GABRA1GABRB2TSHRACHENLRP3
SCHEMBL25838476 0.75 TSHR (0.32) TSHRACHENLRP3L3MBTL1ESR1
SCHEMBL1316916 0.74 TSHR (0.39) GABRA1GABRB2TSHRACHECASR
SCHEMBL14163816 0.73 GABRA1 (0.35) GABRA1GABRB2TSHRACHENLRP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0261962-B1 PROCESS FOR PRODUCING PROPYLENE BLOCK COPOLYMER MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-07-28 EP disclosed
EP-0261962-A2 Process for producing propylene block copolymer MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-03-30 EP disclosed