SCHEMBL48413

SCHEMBL48413

Sc1cc(Cl)c(Cl)c(Cl)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.59
HPGD P15428 5/20 0.46
HSD17B10 Q99714 5/20 0.46
TSHR P16473 4/20 0.46
HSP90AA1 P07900 1/20 0.46
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 1/20 0.39
AHR P35869 11/20 0.37
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
CASP1 P29466 1/20 0.36
AKR1B1 P15121 1/20 0.33
CYP1B1 Q16678 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
SCHEMBL4229727 0.97 CYP3A4 (0.56) CYP3A4HPGDHSD17B10TSHRHSP90AA1
Pyridine SCHEMBL1989293 0.82 CYP3A4 (0.40) CYP3A4HPGDHSD17B10TSHRHSP90AA1
SCHEMBL9480774 0.79 CYP3A4 (0.40) CYP3A4HPGDHSD17B10TSHRHSP90AA1
SCHEMBL9643509 0.79 CYP3A4 (0.47) CYP3A4HPGDHSD17B10TSHRHSP90AA1
SCHEMBL8371112 0.79 CYP3A4 (0.47) CYP3A4HPGDHSD17B10TSHRHSP90AA1
Pentachlorobenzene SCHEMBL11455164 0.75 CYP3A4 (1.00) CYP3A4HPGDHSD17B10TSHRHSP90AA1
Pentachlorobenzene SCHEMBL183144 0.75 CYP3A4 (1.00) CYP3A4HPGDHSD17B10TSHRHSP90AA1
Pentachlorobenzene SCHEMBL11366199 0.73 CYP3A4 (0.79) CYP3A4HPGDHSD17B10TSHRHSP90AA1
SCHEMBL331398 0.73 ALDH1A1 (0.53) CYP3A4HPGDHSD17B10TSHRHSP90AA1
SCHEMBL9194533 0.73 ALDH1A1 (0.61) CYP3A4HPGDHSD17B10TSHRALDH1A1

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 872 patents — showing the first 20. 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-7888432-B2 Having center, cover, or intermediate layer including reaction product that includes resilient polymer component, free radical source, zinc dimethacrylate and halogenated organosulfur compound; improved coefficient of restitution and increased compression ACUSHNET COMPANY (US) 2011-02-15 US claimed
US-7655732-B2 Low compression, resilient golf balls with rubber core ACUSHNET COMPANY (US) 2010-02-02 US claimed
US-20090156751-A1 Aromatic Organosulfur Functionalized 1,4-cis Polybutadiene KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2009-06-18 US claimed
US-20090011856-A1 LOW COMPRESSION, RESILIENT GOLF BALLS WITH RUBBER CORE JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2009-01-08 US claimed
US-7446150-B2 Low compression, resilient golf balls with rubber core ACUSHNET COMPANY (US) 2008-11-04 US claimed
US-20080214739-A1 High cor golf ball using zinc dimethacrylate ACUSHNET COMPANY 2008-09-04 US claimed
US-7375153-B2 Zinc stearate-cis-to-trans catalyst blends for improved golf ball core compositions ACUSHNET COMPANY (US) 2008-05-20 US claimed
US-7342073-B2 High CoR golf ball using zinc dimethacrylate ACUSHNET COMPANY (US) 2008-03-11 US claimed
US-20040225064-A1 Golf ball core compositions comprising unsaturated long chain organic acids and their salts JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-11 US claimed
US-6762247-B2 ABRASION RESISTANCE; FEEL; REDUCED HARDNESS AND MODULUS; MODIFIED BUTADIENE POLYMER ACUSHNET COMPANY 2004-07-13 US claimed
US-20030207998-A1 Use of halogenated organosulfur and peroxide compounds in golf balls ACUSHNET COMPANY 2003-11-06 US claimed
US-6635716-B2 Golf ball core having decreased compression and/or increased coefficient of restitution ACUSHNET COMPANY 2003-10-21 US claimed
US-20030134955-A1 Polybutadiene rubber composition comprising a halogenated organosulfur compound or a metal salt thereof JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2003-07-17 US claimed
US-20030130396-A1 Golf ball cores comprising a halogenated organosulfur compound ACUSHNET COMPANY 2003-07-10 US claimed
US-20030119989-A1 Low compression, resilient golf balls with rubber core ACUSHNET COMPANY 2003-06-26 US claimed
US-20030114249-A1 Golf ball core compositions comprising unsaturated long chain organic acids and their salts JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2003-06-19 US claimed
US-20030064826-A1 Golf ball cores comprising a halogenated organosulfur compound JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2003-04-03 US claimed
US-20020098915-A1 Thin, thermoset, polyurethane-covered golf ball with a dual core JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2002-07-25 US claimed