SCHEMBL16018488

SCHEMBL16018488

C=C(C)C(=O)OC1(CCC(C)C)CCCCCC1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
ALDH1A1 P00352 1/20 0.31
CETP P11597 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
SCHEMBL10542177 1.00 TSHR (0.40) TSHRALDH1A1CETP
SCHEMBL21332436 0.87 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL22772600 0.87 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL21338913 0.87 ALDH1A1 (0.37) TSHRALDH1A1
SCHEMBL21332849 0.85 ALDH1A1 (0.38) TSHRALDH1A1
SCHEMBL2279388 0.84 TSHR (0.42) TSHRALDH1A1
SCHEMBL12520852 0.82 TSHR (0.36) TSHRALDH1A1
SCHEMBL16018490 0.82 TSHR (0.36) TSHRALDH1A1
SCHEMBL1397278 0.82 TSHR (0.36) TSHRALDH1A1
SCHEMBL13171870 0.80 ALDH1A1 (0.34) TSHRALDH1A1

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
CN-105531260-B Oxime ester photoinitiator 巴斯夫欧洲公司 2019-05-31 CN disclosed
US-9229323-B2 Pattern-forming method JSR CORPORATION (JP) 2016-01-05 US disclosed
US-9229323-B2 Pattern-forming method JSR CORPORATION (JP) 2016-01-05 US disclosed
US-20140255854-A1 PATTERN-FORMING METHOD JSR CORPORATION (JP) 2014-09-11 US disclosed
US-20140255854-A1 PATTERN-FORMING METHOD JSR CORPORATION (JP) 2014-09-11 US disclosed