SCHEMBL29428358

SCHEMBL29428358

C=CC(=O)OC(O)(CCCCC)OC

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
HPGD P15428 1/20 0.44
SMPD1 P17405 1/20 0.41
THRB P10828 2/20 0.39
THRA P10827 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
FDPS P14324 8/20 0.34
GGPS1 O95749 5/20 0.34

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
SCHEMBL11032506 0.81 TSHR (0.48) TSHRHPGDSMPD1THRBTHRA
SCHEMBL31345766 0.80 THRB (0.40) TSHRHPGDTHRB
SCHEMBL28125584 0.80 TSHR (0.45) TSHRHPGDTHRBTHRAZDHHC20
SCHEMBL10715565 0.79 TSHR (0.47) TSHRHPGDSMPD1THRBTHRA
SCHEMBL9359065 0.79 TSHR (0.50) TSHRHPGDSMPD1THRBTHRA
SCHEMBL15572267 0.79 TSHR (0.43) TSHRHPGDSMPD1THRBTHRA
SCHEMBL31008754 0.77 TSHR (0.48) TSHRHPGDSMPD1THRBTHRA
SCHEMBL3243172 0.77 TSHR (0.48) TSHRHPGDSMPD1THRBTHRA
SCHEMBL3247328 0.76 TSHR (0.47) TSHRHPGDSMPD1THRBTHRA
SCHEMBL7787871 0.76 TSHR (0.47) TSHRHPGDSMPD1THRBTHRA

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-20220074134-A1 TEXTILE PRINTING HEWLETT-PACKARD DEVELOPMENT COMPANY, L.P. (US) 2022-03-10 US disclosed