SCHEMBL28055003

SCHEMBL28055003

CC(=CC1COCCO1)C(=O)OCC1CO1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MGLL Q99685 3/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL939873 0.79 RECQL (0.33)
SCHEMBL9441120 0.79
SCHEMBL26908304 0.78
SCHEMBL25388558 0.78 ALDH1A1 (0.33) ALDH1A1
SCHEMBL4416081 0.76 ALDH1A1 (0.65) ALDH1A1TP53CYP3A4MGLL
SCHEMBL147020 0.76 ALDH1A1 (0.65) ALDH1A1TP53CYP3A4MGLL
SCHEMBL27670700 0.75 ALDH1A1 (0.62) ALDH1A1TP53CYP3A4MGLL
SCHEMBL11652007 0.74 ALDH1A1 (0.53) ALDH1A1TP53CYP3A4MGLLLMNA
SCHEMBL4238090 0.73
SCHEMBL11292738 0.73 ALDH1A1 (0.61) ALDH1A1TP53CYP3A4MGLL

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-107119456-B A kind of preparation method of Intelligent mosquito dispelling fabric 广东柏堡龙股份有限公司 2019-07-12 CN claimed
CN-107119456-B A kind of preparation method of Intelligent mosquito dispelling fabric 广东柏堡龙股份有限公司 2019-07-12 CN disclosed
CN-103903817-B A kind of preparation method of transparent conductive film and application thereof Material produce base, Guangzhou Chemistry Co., Ltd. Chinese Academy of Sciences Nanxiong (CN) 2016-04-13 CN disclosed