SCHEMBL6285845

SCHEMBL6285845

CCCC(C)(Cc1ccccc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.62
ESR2 Q92731 2/20 0.62
TAAR1 Q96RJ0 2/20 0.47
SLC6A2 P23975 1/20 0.47
CYP2C19 P33261 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C9 P11712 1/20 0.45
LMNA P02545 1/20 0.44
CYP2D6 P10635 1/20 0.44
HIF1A Q16665 1/20 0.42
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
RECQL P46063 1/20 0.39
TRPA1 O75762 1/20 0.39
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.38
KIF11 P52732 2/20 0.37

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
SCHEMBL9588711 0.88 ESR1 (0.54) ESR1ESR2TAAR1SLC6A2CYP2C19
SCHEMBL26757337 0.85 CYP2C19 (0.50) ESR1ESR2TAAR1CYP2C19CYP1A2
SCHEMBL10601271 0.85 TAAR1 (0.56) ESR1ESR2TAAR1SLC6A2CYP2C19
SCHEMBL10603062 0.84 TAAR1 (0.47) ESR1ESR2TAAR1SLC6A2CYP2C19
SCHEMBL3082120 0.83 ESR1 (0.60) ESR1ESR2TAAR1SLC6A2CYP2C19
SCHEMBL8612395 0.81 CYP2C19 (0.47) ESR1ESR2TAAR1CYP2C19HIF1A
SCHEMBL597345 0.81 CYP2C19 (0.47) ESR1ESR2TAAR1CYP2C19HIF1A
SCHEMBL23786817 0.79 ESR1 (0.51) ESR1ESR2TAAR1SLC6A2CYP2C19
SCHEMBL8157569 0.78 CYP1A2 (0.47) ESR1ESR2TAAR1SLC6A2CYP2C19
SCHEMBL11801078 0.78 TAAR1 (0.54) ESR1ESR2TAAR1CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6967229-B2 Carbon-carbon initiators for use in golf balls ACUSHNET COMPANY (US) 2005-11-22 US claimed
US-20050009992-A1 Carbon-carbon initiators for use in golf balls JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-01-13 US claimed
CN-106133604-B Protectant composition and protectant pattern forming method 三菱瓦斯化学株式会社 2019-09-06 CN disclosed
CN-109073782-A Optical element forms composition and its solidfied material 三菱瓦斯化学株式会社 2018-12-21 CN disclosed
US-9056227-B2 Golf ball comprising a core having a shallow hardness gradient ACUSHNET COMPANY (US) 2015-06-16 US disclosed
US-8968117-B2 Dual-core comprising zero gradient center and positive gradient outer core layer ACUSHNET COMPANY (US) 2015-03-03 US disclosed
US-20130109504-A1 DUAL-CORE COMPRISING ZERO GRADIENT CENTER AND POSITIVE GRADIENT OUTER CORE LAYER ACUSHNET COMPANY (US) 2013-05-02 US disclosed
US-20130109506-A1 GOLF BALL COMPRISING A CORE HAVING A SHALLOW HARDNESS GRADIENT ACUSHNET COMPANY (US) 2013-05-02 US disclosed
US-6967229-B2 Carbon-carbon initiators for use in golf balls ACUSHNET COMPANY (US) 2005-11-22 US disclosed
US-20050009992-A1 Carbon-carbon initiators for use in golf balls JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-01-13 US disclosed
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed