SCHEMBL4307337

SCHEMBL4307337

C=CC(=O)OC(C)SSC(C)OC(=O)C=C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.46
HPGD P15428 1/20 0.35
ALDH1A1 P00352 5/20 0.35
TP53 P04637 3/20 0.34
HIF1A Q16665 3/20 0.34
CYP3A4 P08684 2/20 0.34
HSD17B10 Q99714 1/20 0.34
HCAR2 Q8TDS4 1/20 0.33
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 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
SCHEMBL672391 0.88 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2435317 0.86
SCHEMBL7709947 0.84 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28029833 0.84 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2432049 0.84 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28107882 0.83 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL7563890 0.82 TSHR (0.45) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2425036 0.81 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL29134968 0.81 TSHR (0.39) TSHRHPGD
SCHEMBL11857298 0.81 TSHR (0.39) TSHRHPGDALDH1A1CYP3A4

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
US-20220229065-A1 SENSORS AND METHODS FOR RAPID MICROBIAL DETECTION BAMBU VAULT LLC (US) 2022-07-21 US disclosed
WO-2020243008-A1 SENSORS AND METHODS FOR RAPID MICROBIAL DETECTION BAMBU VAULT LLC (US) 2020-12-03 WO disclosed
US-20160008289-A1 Tetrary Gene Delivery System for Gene Therpay and Methods of Its Use UNIVERSITY OF SOUTH CAROLINA 2016-01-14 US disclosed
US-9168230-B2 Tetrary gene delivery system for gene therapy and methods of its use UNIVERSITY OF SOUTH CAROLINA (US) 2015-10-27 US disclosed
US-20120301512-A1 Tetrary Gene Delivery System for Gene Therapy and Methods of Its Use UNIVERSITY OF SOUTH CAROLINA (US) 2012-11-29 US disclosed
WO-2009132206-A1 COMPOSITIONS AND METHODS FOR INTRACELLULAR DELIVERY AND RELEASE OF CARGO LIQUIDIA TECHNOLOGIES, INC. (US) 2009-10-29 WO disclosed