SCHEMBL4412838

SCHEMBL4412838

Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1Cc1c(C)cc(C(C)(C)C)cc1C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 7/20 0.52
HTR1B P28222 5/20 0.47
HTR1A P08908 4/20 0.43
ADRA2A P08913 4/20 0.43
ADRA2B P18089 3/20 0.43
ADRA2C P18825 3/20 0.43
CYP2D6 P10635 3/20 0.43
TSHR P16473 3/20 0.43
LMNA P02545 3/20 0.43
TP53 P04637 2/20 0.43
CHRM2 P08172 2/20 0.43
CHRM1 P11229 2/20 0.43
ADRA1D P25100 2/20 0.43
HTR2A P28223 2/20 0.43
HTR2C P28335 2/20 0.43
ADRA1A P35348 2/20 0.43
ADRA1B P35368 2/20 0.43
DRD3 P35462 2/20 0.43
HTR2B P41595 2/20 0.43
DRD2 P14416 1/20 0.43

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
SCHEMBL26876706 0.84 HTR1D (0.55) HTR1DHTR1BHTR1AADRA2AADRA2B
SCHEMBL15064207 0.83 HTR1D (0.48) HTR1DHTR1BHTR1AADRA2AADRA2B
SCHEMBL6668865 0.83 HTR1D (0.48) HTR1DHTR1BHTR1AADRA2AADRA2B
SCHEMBL11087884 0.80 THRA (0.44) HTR1DHTR1BTSHRLMNACYP3A4
SCHEMBL10891430 0.78 CYP2C9 (0.46) HTR1DHTR1BHTR1AADRA2AADRA2B
SCHEMBL6299373 0.78 ALDH1A1 (0.44) HTR1DHTR1BCYP2D6TSHRLMNA
SCHEMBL7574023 0.78 HTR1D (0.44) HTR1DHTR1BHTR1AADRA2AADRA2B
SCHEMBL11087876 0.78 HSPA5 (0.44) HTR1DHTR1BCYP2D6TSHRCYP3A4
SCHEMBL26874266 0.77 HTR1D (0.43) HTR1DHTR1BHTR1AADRA2AADRA2B
SCHEMBL13672404 0.76 HTR1D (0.50) HTR1DHTR1BHTR1AADRA2AADRA2B

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
EP-3168252-B1 POLYKETONE MOULDING MATERIALS WITH IMPROVED PROPERTIES, MOULDED PARTS PRODUCED THEREFROM AND METHOD FOR ITS MANUFACTURE EMS PATENT AG (CH) 2019-01-09 EP claimed
EP-3168253-B1 FLAME RETARDANT ALIPHATIC POLYKETONE MASSES, MOULDS OBTAINED FROM THESE AND METHOD FOR PREPARING THE SAME EMS PATENT AG (CH) 2018-04-11 EP claimed
EP-1379584-B1 FLAME RETARDANT COMPOSITIONS CIBA SC HOLDING AG (CH) 2005-08-24 EP claimed
CN-113166467-A Polyethylene or polypropylene articles 巴斯夫欧洲公司 2021-07-23 CN disclosed
EP-2502638-B1 COMPOSITION FOR HARD TISSUE REPAIR MITSUI CHEMICALS INC (JP) 2018-02-21 EP disclosed
EP-2640777-B1 STABILIZER COMPOSITION FOR POLYMERS BASF SE (DE) 2015-01-07 EP disclosed
EP-2502638-A1 COMPOSITION FOR HARD TISSUE REPAIR Mitsui Chemicals, Inc. (JP) 2012-09-26 EP disclosed
EP-1513893-B1 FLAME RETARDANT POLYMER COMPOSITIONS CONTAINING HYDROXYLAMINE ESTERS CIBA HOLDING INC (CH) 2009-01-07 EP disclosed
EP-1507824-B1 STABILIZED ARTICLES CIBA SC HOLDING AG (CH) 2008-03-12 EP disclosed
EP-1263833-A1 ROMP WITH OLIGOMERIC UV-ABSORBERS Ciba SC Holding AG (CH) 2002-12-11 EP disclosed
WO-2001062821-A1 ROMP WITH OLIGOMERIC UV-ABSORBERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-08-30 WO disclosed