SCHEMBL3844071

SCHEMBL3844071

COC(C)(c1ccccc1)C(C)(OC)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 3/20 0.48
ALOX15 P16050 1/20 0.48
CES1 P23141 1/20 0.43
KCNN4 O15554 4/20 0.43
TAAR1 Q96RJ0 1/20 0.42
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 2/20 0.39
CA4 P22748 1/20 0.39
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL12678312 0.85 MAPK1 (0.44) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL17135263 0.85 MAPK1 (0.44) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL17472240 0.85 MAPK1 (0.44) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL28557443 0.85 ALDH1A1 (0.46) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL17680157 0.82 KCNN4 (0.46) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL664301 0.78 MAPK1 (0.52) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL42639 0.78 MAPK1 (0.67) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL204375 0.78 MAPK1 (0.52) MAPK1ALDH1A1ALOX15CES1KCNN4
SCHEMBL15899482 0.77 CES1 (0.44) MAPK1ALDH1A1ALOX15CES1KCNN4
Methoxytriphenylmethane SCHEMBL9103 0.74 MAPK1 (0.48) MAPK1ALDH1A1ALOX15CES1KCNN4

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 44 patents — showing the first 20. 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
EP-0273274-B1 Degradation of polyethylene by means of agents generating free radicals ATOCHEM ELF DEUTSCHLAND (DE) 2000-07-12 EP claimed
US-3944511-A Chemically modified polymers OWENS-ILLINOIS, INC. (US) 1976-03-16 US claimed
US-20170165940-A1 LAMINATE AND METHOD OF PRODUCTION OF BUILT-UP BOARD ZEON CORPORATION (JP) 2017-06-15 US 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-20130109506-A1 GOLF BALL COMPRISING A CORE HAVING A SHALLOW HARDNESS GRADIENT ACUSHNET COMPANY (US) 2013-05-02 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-7556860-B2 Laminate and method of forming the same, insulating film, and semiconductor device JSR CORPORATION (JP) 2009-07-07 US disclosed
EP-1245638-B1 Composition for insulating film formation JSR CORP (JP) 2009-01-14 EP disclosed
EP-1188807-B1 Chemical mechanical polishing stopper film, process for producing the same, and method of chemical mechanical polishing JSR CORP (JP) 2007-10-17 EP disclosed
EP-1122746-A1 Composition for film formation and insulating film JSR Corporation (JP) 2001-08-08 EP disclosed
EP-1099719-A1 Diyne-containing (co) polymer, processes for producing the same, and cured film JSR Corporation (JP) 2001-05-16 EP disclosed
EP-0273274-B1 Degradation of polyethylene by means of agents generating free radicals ATOCHEM ELF DEUTSCHLAND (DE) 2000-07-12 EP disclosed
EP-0940419-A1 AROMATIC COPOLYMER AND COMPOSITION CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1999-09-08 EP disclosed
EP-0190720-B1 PROCESS FOR THE DEHYDROGENATIVE DIMERIZATION AND/OR POLYMERIZATION OF ORGANIC COMPOUNDS WITH ACTIVE HYDROGEN ATOMS USING PERKETALS Luperox GmbH (DE) 1988-11-02 EP disclosed
EP-0273274-A2 Degradation of polyethylene by means of agents generating free radicals Elf Atochem Deutschland GmbH (DE) 1988-07-06 EP disclosed
EP-0190720-A1 Process for the dehydrogenative dimerization and/or polymerization of organic compounds with active hydrogen atoms using perketals Luperox GmbH (DE) 1986-08-13 EP disclosed
US-3944511-A Chemically modified polymers OWENS-ILLINOIS, INC. (US) 1976-03-16 US disclosed