SCHEMBL28077327

SCHEMBL28077327

Cc1cc(C)cc(-c2ccc(O)c(-c3cc(C)cc(C)c3)c2O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.46
CNR1 P21554 9/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SELL P14151 1/20 0.41
SELP P16109 1/20 0.41
SELE P16581 1/20 0.41
ACLY P53396 1/20 0.40
TRPA1 O75762 1/20 0.38
AMY1A P0DUB6 1/20 0.37
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 1/20 0.37
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
ELANE P08246 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36

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
Ethane SCHEMBL28865517 0.82 CA1 (0.50) MEN1KMT2AALDH1A1TDP1TP53
SCHEMBL5459938 0.76 CNR2 (0.53) CNR2CNR1MEN1KMT2AACLY
SCHEMBL28077328 0.76 CNR2 (0.48) CNR2CNR1MEN1KMT2ASELL
SCHEMBL18171961 0.74 TRPA1 (0.52) CNR2CNR1MEN1KMT2ATRPA1
SCHEMBL27619639 0.74 ALOX5 (0.56) CNR2CNR1ALDH1A1
SCHEMBL31179852 0.73 RPS6KA3 (0.41) CNR2CNR1MEN1KMT2AACLY
SCHEMBL21801277 0.73 RPS6KA3 (0.41) CNR2CNR1MEN1KMT2AACLY
SCHEMBL14417222 0.73 IDO1 (0.52) CNR2CNR1
SCHEMBL1860042 0.72 ALDH1A1 (0.44) CNR2CNR1TRPA1AMY1AALDH1A1
SCHEMBL5688145 0.72 TSHR (0.56) CNR2CNR1ALDH1A1KDM4ECYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105623137-B Thermoplastic resin composition and molded article produced therefrom LG化学株式会社 2018-06-08 CN disclosed
CN-104169350-B NOR HALS compounds as fire retardant 巴斯夫欧洲公司 2017-11-21 CN disclosed
CN-105623137-A Thermoplastic resin composition and molded article produced therefrom LG CHEMICAL LTD 2016-06-01 CN disclosed