SCHEMBL28439799

SCHEMBL28439799

CCCCCCCCB(CCCCCCCC)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
EPHX2 P34913 2/20 0.44
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PKM P14618 1/20 0.44
HTT P42858 2/20 0.43
KCNH2 Q12809 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
PCSK9 Q8NBP7 1/20 0.41
CETP P11597 1/20 0.41
CYP19A1 P11511 2/20 0.41

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
SCHEMBL5953639 0.92 PCSK9 (0.48) DNM1MEN1KMT2AEPHX2TP53
SCHEMBL21123807 0.80 KCNH2 (0.43) DNM1MEN1KMT2AEPHX2TP53
SCHEMBL20201957 0.79 TP53 (0.46) TP53SMN1; SMN2SIGMAR1PCSK9CYP19A1
SCHEMBL9189726 0.76 PCSK9 (0.50) DNM1MEN1KMT2AEPHX2TP53
Lithium SCHEMBL9003795 0.74 KCNH2 (0.50) KCNH2SIGMAR1PCSK9
SCHEMBL23553935 0.73 TP53 (0.50) TP53
Hexadecane SCHEMBL10591100 0.73 TP53 (0.74) DNM1MEN1KMT2AEPHX2TP53
Decane SCHEMBL10591097 0.73 TP53 (0.74) DNM1MEN1KMT2AEPHX2TP53
Ethylbenzene SCHEMBL798422 0.73 TP53 (0.74) DNM1MEN1KMT2AEPHX2TP53
Ethylbenzene SCHEMBL3882350 0.73 TP53 (0.74) DNM1MEN1KMT2AEPHX2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107207712-B Process for preparing a graft copolymer comprising a polyolefin backbone and one or more polymeric side chains and product obtained from said process SABIC环球技术有限责任公司 2020-08-07 CN disclosed