SCHEMBL22115756

SCHEMBL22115756

COCCOC(=O)C(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
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
SCHEMBL20469685 0.94 TSHR (0.35) TSHRCA12CA1CA2CA9
SCHEMBL20469651 0.94 TSHR (0.35) TSHRCA12CA1CA2CA9
SCHEMBL12392809 0.94 TSHR (0.35) TSHRCA12CA1CA2CA9
SCHEMBL22115767 0.82 TSHR (0.35) TSHRCA12CA1CA2CA9
SCHEMBL803570 0.80 GRM1 (0.38) TSHRCA1CA2ALDH1A1
SCHEMBL803788 0.80 GRM1 (0.38) TSHRCA1CA2ALDH1A1
SCHEMBL14108248 0.80 TSHR (0.37) TSHRALDH1A1
SCHEMBL25565783 0.80 TSHR (0.39) TSHRCA12CA1CA2CA9
SCHEMBL804112 0.79 ALDH1A1 (0.52) TSHRSMN1; SMN2ALDH1A1
SCHEMBL803636 0.79 ALDH1A1 (0.52) TSHRSMN1; SMN2ALDH1A1

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
US-11427657-B2 Solid catalyst for propylene polymerization and method of producing block copolymer using the same HANWHA TOTAL PETROCHEMICAL CO., LTD. (KR) 2022-08-30 US disclosed
US-20200199266-A1 Solid Catalyst For Propylene Polymerization And Method Of Producing Block Copolymer Using The Same HANWHA TOTALENERGIES PETROCHEMICAL CO., LTD. (KR) 2020-06-25 US disclosed
EP-3670546-A1 SOLID CATALYST FOR PROPYLENE POLYMERIZATION AND METHOD OF PRODUCING BLOCK COPOLYMER USING THE SAME Hanwha Total Petrochemical Co., Ltd. (KR) 2020-06-24 EP disclosed