SCHEMBL9875772

SCHEMBL9875772

CC(C)c1cccc2c(CCc3ccccc3)ccc-2c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.41
RXRA P19793 2/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PTGER4 P35408 5/20 0.37
PTGER3 P43115 5/20 0.37
PTGER1 P34995 4/20 0.37
PTGER2 P43116 4/20 0.37
PTPN5 P54829 2/20 0.37
KIF11 P52732 1/20 0.37
FFAR1 O14842 1/20 0.36
IDO1 P14902 1/20 0.36
IDO2 Q6ZQW0 1/20 0.36
LMNA P02545 1/20 0.36
NR4A2 P43354 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
SCHEMBL9875538 0.86 RXRA (0.42) RXRARXRBRXRGPTGER4PTGER3
SCHEMBL9876309 0.83 CTSS (0.44) PPARARXRARXRBRXRGPTGER4
SCHEMBL9627854 0.81 RXRA (0.43) RXRARXRBRXRGMEN1KMT2A
SCHEMBL9875245 0.80 CTSS (0.39) PPARARXRARXRBRXRGPTPN5
SCHEMBL9618739 0.79 RXRA (0.46) PPARARXRARXRBRXRGMEN1
SCHEMBL11167064 0.78 MAOA (0.50) KIF11
SCHEMBL9876048 0.78 MEN1 (0.40) PPARARXRARXRBRXRGMEN1
SCHEMBL9875860 0.78 MEN1 (0.40) PPARARXRARXRBRXRGMEN1
SCHEMBL9874563 0.78 MEN1 (0.40) PPARARXRARXRBRXRGMEN1
SCHEMBL9876409 0.78 MEN1 (0.40) PPARARXRARXRBRXRGMEN1

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-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed