SCHEMBL1949514

SCHEMBL1949514

ClSc1cccnc1SCl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.39
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 4/20 0.38
THRB P10828 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TDP1 Q9NUW8 3/20 0.33
TDP2 O95551 1/20 0.33
NSD2 O96028 1/20 0.33
ABL1 P00519 1/20 0.33
PLCG1 P19174 1/20 0.33
CES1 P23141 1/20 0.33
PAX8 Q06710 1/20 0.33
RIN1 Q13671 1/20 0.33

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
SCHEMBL9395972 0.76
SCHEMBL27013272 0.74
SCHEMBL14452721 0.71 KDM4E (0.54) PKMKDM4EALDH1A1SMN1; SMN2HPGD
SCHEMBL16926607 0.70 MAPT (0.52) KDM4EALDH1A1SMN1; SMN2CYP3A4MEN1
SCHEMBL1950724 0.70
SCHEMBL795882 0.67 MEN1 (0.62) PKMALDH1A1SMN1; SMN2CYP1A2CYP2C9
SCHEMBL1953073 0.67 PKM (0.35) PKMKDM4EALDH1A1THRBSMN1; SMN2
SCHEMBL2113502 0.67 PKM (0.35) PKMKDM4EALDH1A1THRBSMN1; SMN2
SCHEMBL1950738 0.67 EHMT2 (0.36) PKMKDM4EALDH1A1THRBSMN1; SMN2
SCHEMBL10833630 0.67 L3MBTL1 (0.47) KDM4EHPGDMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198378-B2 Aromatic organosulfur functionalized 1,4-cis polybutadiene KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2012-06-12 US claimed
US-20110136956-A1 1,4-CIS-POLYBUTADIENE FUNCTIONALIZED WITH ORGANOSULFUR COMPOUND FOR PREPARATION OF GOLF BALL CORE KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2011-06-09 US claimed
US-20090156751-A1 Aromatic Organosulfur Functionalized 1,4-cis Polybutadiene KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2009-06-18 US claimed
CN-101456928-A Aromatic organosulfur functionalized 1,4-cis polybutadiene KUMHO PETROCHEMICAL CO LTD (KR) 2009-06-17 CN claimed
US-8552120-B2 Grafted and functionalized high 1,4-trans polybutadiene with aromatic organosulfur compound KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2013-10-08 US disclosed
US-8198378-B2 Aromatic organosulfur functionalized 1,4-cis polybutadiene KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2012-06-12 US disclosed
US-20110136956-A1 1,4-CIS-POLYBUTADIENE FUNCTIONALIZED WITH ORGANOSULFUR COMPOUND FOR PREPARATION OF GOLF BALL CORE KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2011-06-09 US disclosed
CN-101735363-A Grafted and functionalized high 1,4-trans polybutadiene with aromatic organosulfur compound KOREA KUMHO PETROCHEM CO LTD 2010-06-16 CN disclosed
US-20100081770-A1 GRAFTED AND FUNCTIONALIZED HIGH 1,4-TRANS POLYBUTADIENE WITH AROMATIC ORGANOSULFUR COMPOUND KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2010-04-01 US disclosed
US-20090156751-A1 Aromatic Organosulfur Functionalized 1,4-cis Polybutadiene KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2009-06-18 US disclosed
CN-101456928-A Aromatic organosulfur functionalized 1,4-cis polybutadiene KUMHO PETROCHEMICAL CO LTD (KR) 2009-06-17 CN disclosed