SCHEMBL19639028

SCHEMBL19639028

Cc1c(C)c2c(C)cccc2[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.47
DDO Q99489 2/20 0.47
PARP1 P09874 4/20 0.45
BRD4 O60885 1/20 0.44
KDM4E B2RXH2 2/20 0.43
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
CYP1A2 P05177 1/20 0.42
ALDH1A1 P00352 1/20 0.41
GLA P06280 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
CHEK1 O14757 1/20 0.41

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
SCHEMBL1921411 0.77 AHR (0.50) DAOPARP1KDM4ECYP1A2GAA
SCHEMBL3125353 0.76 PARP1 (0.49) DAODDOPARP1BRD4KDM4E
SCHEMBL30013759 0.76 PARP1 (0.49) DAODDOPARP1BRD4KDM4E
SCHEMBL6008331 0.75 GPR84 (0.48) DAODDOPARP1CYP1A2ALDH1A1
SCHEMBL30715250 0.75 GPR84 (0.48) DAODDOPARP1CYP1A2ALDH1A1
Iodide SCHEMBL27978084 0.75 AHR (0.48) DAOPARP1KDM4ECYP1A2GAA
Bromide SCHEMBL28157431 0.75 AHR (0.48) DAOPARP1KDM4ECYP1A2GAA
SCHEMBL10518629 0.74 CYP1A2 (0.44) DAODDOPARP1CYP1A2HTT
SCHEMBL30442759 0.73 BRD4 (0.54) DAODDOPARP1BRD4KDM4E
SCHEMBL8580170 0.73 DAO (0.66) DAODDOPARP1BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10435543-B2 Rubber or elastomer compositions and processes for their manufacturing LEIBNIZ-INSTITUT FUER POLYMERFORSCHUNG DRESDEN E.V. (DE) 2019-10-08 US claimed
US-20170342240-A1 RUBBER OR ELASTOMER COMPOSITIONS AND PROCESSES FOR THEIR MANUFACTURING LEIBNIZ-INSTITUT FUER POLYMERFORSCHUNG DRESDEN E.V. (DE) 2017-11-30 US claimed
US-20240191028-A1 COMPOSITION FOR MANUFACTURING POLYIMIDE FILM AND POLYIMIDE FILM FOR FLEXIBLE METAL CLAD LAMINATE MANUFACTURED USING THE SAME NEXFLEX CO., LTD. (KR) 2024-06-13 US disclosed
US-10435543-B2 Rubber or elastomer compositions and processes for their manufacturing LEIBNIZ-INSTITUT FUER POLYMERFORSCHUNG DRESDEN E.V. (DE) 2019-10-08 US disclosed
US-20170342240-A1 RUBBER OR ELASTOMER COMPOSITIONS AND PROCESSES FOR THEIR MANUFACTURING LEIBNIZ-INSTITUT FUER POLYMERFORSCHUNG DRESDEN E.V. (DE) 2017-11-30 US disclosed