SCHEMBL11043889

SCHEMBL11043889

CCCC(C)C[Al](CC(C)CCC)CC(C)CCC.CCCCCC[Al](CCCCCC)CCCCCC

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
DNM1 Q05193 2/20 0.34
OPRM1 P35372 1/20 0.33
THRB P10828 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
SPHK1 Q9NYA1 1/20 0.32
LMNA P02545 1/20 0.31
GPR84 Q9NQS5 4/20 0.31
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
ADH7 P40394 1/20 0.31

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
SCHEMBL126546 0.82 TSHR (0.48) TSHR
SCHEMBL818787 0.80 TSHR (0.38) TSHRDNM1OPRM1THRBSPHK1
SCHEMBL11664749 0.80 TSHR (0.38) TSHRDNM1OPRM1THRBSPHK1
SCHEMBL27507309 0.80 TSHR (0.38) TSHRDNM1OPRM1THRBSPHK1
SCHEMBL8600221 0.78 TSHR (0.37) TSHR
SCHEMBL125448 0.77 DNM1 (0.38) TSHRDNM1OPRM1ACE2LMNA
SCHEMBL1818542 0.77 TSHR (0.43) TSHRACE2
SCHEMBL23040209 0.76 TSHR (0.57) TSHRDNM1THRBLMNA
SCHEMBL80948 0.76 TSHR (0.57) TSHRDNM1THRBLMNA
Hexane SCHEMBL1047425 0.76 TSHR (0.57) TSHRDNM1THRBLMNA

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-0103120-A2 Process for producing a catalyst component used for the polymerization of alpha-olefins TOYO STAUFFER CHEMICAL CO. LTD. (JP) 1984-03-21 EP disclosed
EP-0102503-A2 Process for producing a catalyst component used for the polymerization of alpha-olefins TOYO STAUFFER CHEMICAL CO. LTD. (JP) 1984-03-14 EP disclosed