SCHEMBL4455811

SCHEMBL4455811

C=C(C)C(=O)OCC1(C(C)(CO)CO)CC1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.38
ALDH1A1 P00352 2/20 0.38
THRB P10828 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
SCHEMBL23501494 0.78 TSHR (0.39) TSHRALDH1A1THRB
SCHEMBL2880702 0.75 ALDH1A1 (0.42) TSHRALDH1A1THRB
SCHEMBL20925620 0.74 TSHR (0.45) TSHRALDH1A1THRB
SCHEMBL4136550 0.72 TSHR (0.47) TSHRALDH1A1THRB
SCHEMBL11921513 0.69 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL4126704 0.69 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL4123676 0.69 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL4122914 0.69 TSHR (0.44) TSHRALDH1A1THRB
SCHEMBL11148390 0.69 ALDH1A1 (0.43) TSHRALDH1A1THRB
SCHEMBL75652 0.69 TSHR (0.40) TSHRALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286020-A1 PHOTOSENSITIVE DRY FILM FOR PRODUCTION OF THREE-DIMENSIONAL MICRO-MOLDED PRODUCT, AND PHOTOSENSITIVE RESIN COMPOSITION TOKYO OHKA KOGYO CO., LTD. (JP) 2009-11-19 US disclosed