SCHEMBL28259671

SCHEMBL28259671

C=CC(CC)(CCCCCC)OC

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.37
THRB P10828 1/20 0.32
SMPD1 P17405 3/20 0.32
GGPS1 O95749 6/20 0.31
FDPS P14324 8/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7060068 0.85 TSHR (0.36) TSHRTHRBSMPD1GGPS1FDPS
SCHEMBL21847342 0.78
SCHEMBL3482595 0.78 ALDH1A1 (0.31) TSHRALDH1A1
SCHEMBL15302563 0.75 TSHR (0.34) TSHRALDH1A1
SCHEMBL3482186 0.72 TSHR (0.33) TSHRALDH1A1
SCHEMBL27697856 0.72
SCHEMBL17479115 0.71 TSHR (0.48) TSHRTHRBSMPD1GGPS1FDPS
SCHEMBL3482214 0.69 ALDH1A1 (0.31) TSHRALDH1A1
SCHEMBL1818969 0.69 TSHR (0.39) TSHRSMPD1ALDH1A1
SCHEMBL4791137 0.69 TSHR (0.46) TSHRTHRBSMPD1GGPS1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115813777-A Cosmetic composition comprising capsules 科丝美诗株式会社 2023-03-21 CN disclosed
CN-110049754-B Fatty acid ethyl ester for cosmetics CJ第一制糖株式会社 2022-12-06 CN disclosed
CN-108883316-B Skin-lightening, sunscreen, vitamin D-generating compositions 欧内斯特·阿姆斯特朗 2021-11-19 CN disclosed
CN-113573689-A Sunscreen compositions comprising butyl methoxydibenzoylmethane, triazine derivatives and light stabilizers 巴斯夫欧洲公司 2021-10-29 CN disclosed
CN-110049754-A Fatty-acid ethyl ester for cosmetic product CJ第一制糖株式会社 2019-07-23 CN disclosed
CN-108883316-A Skin-lightening, sunscreen, vitamin D-generating compositions 欧内斯特·阿姆斯特朗 2018-11-23 CN disclosed