SCHEMBL22008359

SCHEMBL22008359

CC(c1cccc(CO)c1)c1cccc(-c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.49
ADAMTS4 O75173 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
PTGS2 P35354 2/20 0.43
TSHR P16473 1/20 0.42
ACMSD Q8TDX5 1/20 0.42
HPGDS O60760 1/20 0.41
CTSL P07711 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
PTGES O14684 1/20 0.40
SDCBP O00560 1/20 0.40
SDC2 P34741 1/20 0.40
PTPN5 P54829 2/20 0.39
CNR2 P34972 1/20 0.39
CFD P00746 1/20 0.39
F11 P03951 1/20 0.39
TPSB2 P20231 1/20 0.39

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
SCHEMBL23713528 0.90 TSHR (0.48) TSHRHPGDS
SCHEMBL11888529 0.88 ENPP2 (0.45) PRKCITSHR
SCHEMBL249824 0.80 PRKCI (0.70) PRKCITSHRACMSDCNR2AGXT
SCHEMBL30108284 0.80 PRKCI (0.70) PRKCITSHRACMSDCNR2AGXT
SCHEMBL18733604 0.77 HDAC4 (0.49) PRKCIADAMTS4RXRARXRBRXRG
SCHEMBL3279344 0.76 HDAC4 (0.47) PRKCIRXRARXRBRXRGTSHR
SCHEMBL13524585 0.76 RXRA (0.58) PRKCIADAMTS4RXRARXRBRXRG
SCHEMBL25470940 0.76 TSHR (0.45) ADAMTS4TSHRACMSDHPGDS
SCHEMBL18297788 0.75 PRKCI (0.76) PRKCIADAMTS4TSHRACMSDCNR2
SCHEMBL23750160 0.74 PRKCI (0.63) PRKCIADAMTS4TSHRACMSDCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230374325-A1 PROCESS MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-11746284-B2 Composition comprising a semiconducting light emitting nanoparticle MERCK PATENT GMBH (DE) 2023-09-05 US disclosed
US-20230052397-A1 COMPOSITION MERCK PATENT GMBH (DE) 2023-02-16 US disclosed
US-20200157419-A1 COMPOSITION COMPRISING A SEMICONDUCTING LIGHT EMITTING NANOPARTICLE MERCK PATENT GMBH (DE) 2020-05-21 US disclosed