SCHEMBL5573143

SCHEMBL5573143

CC(C)(C)c1cc(C2(N)CCCCCC2)cc(C(C)(C)C)c1O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.45
CA1 P00915 2/20 0.45
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.44
TYR P14679 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTT P42858 1/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
HPN P05981 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
SIRT5 Q9NXA8 1/20 0.40

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
SCHEMBL297823 0.81 ACHE (0.58) CA2CA1ALDH1A1POLBTYR
SCHEMBL9348255 0.77 LMNA (0.49) CA2CA1ALDH1A1POLBTYR
SCHEMBL17532650 0.76 CA2 (0.50) CA2CA1ALDH1A1POLBTYR
Bicarbonate SCHEMBL11054659 0.75 GLRA3 (0.43) CA2CA1ALDH1A1POLBTYR
SCHEMBL10703712 0.75 AKR1C1 (0.47) CA2CA1ALDH1A1POLBTYR
SCHEMBL8849891 0.75 AKR1C1 (0.47) CA2CA1ALDH1A1POLBTYR
SCHEMBL5573050 0.75
SCHEMBL5668821 0.75
SCHEMBL9807748 0.72 ACHE (0.71) CA2CA1ALDH1A1POLBTYR
SCHEMBL11857302 0.72 SMN1; SMN2 (0.42) CA2CA1ALDH1A1POLBTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220153885-A1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2022-05-19 US disclosed
EP-3458488-B1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORP (JP) 2020-12-30 EP disclosed
US-20190185598-A1 Process For Producing Functionalized Polymers BRIDGESTONE CORPORATION (JP) 2019-06-20 US disclosed
EP-3458488-A1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS Bridgestone Corporation (JP) 2019-03-27 EP disclosed
WO-2017201397-A1 PROCESS FOR PRODUCING FUNCTIONALIZED POLYMERS BRIDGESTONE CORPORATION (JP) 2017-11-23 WO disclosed
US-7211619-B2 Stabilizing high-vinyl polybutadiene BRIDGESTONE CORPORATION (JP) 2007-05-01 US disclosed
US-20030040594-A1 Stabilizing high-vinyl polybutadiene BRIDGESTONE CORP. 2003-02-27 US disclosed