SCHEMBL25792964

SCHEMBL25792964

CC1(C)CCC(C)(C)c2cc(-c3nc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)nc(-c4ccc5sc6ccccc6c5c4)n3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARB P10826 14/20 0.41
RARG P13631 13/20 0.41
RXRA P19793 5/20 0.41
RARA P10276 14/20 0.37
ABCB1 P08183 1/20 0.33
ABCC1 P33527 1/20 0.33
RXRB P28702 2/20 0.32
RXRG P48443 2/20 0.32
RORC P51449 1/20 0.32

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
SCHEMBL21707342 0.91 GPR3 (0.35)
SCHEMBL25792963 0.90 RARB (0.43) RARBRARGRXRARARAABCB1
SCHEMBL15501881 0.88 MAPT (0.34)
SCHEMBL25789915 0.87 RARB (0.51) RARBRARGRXRARARAABCB1
SCHEMBL15501378 0.86 PIM3 (0.37)
SCHEMBL17693930 0.86 PIM3 (0.37)
SCHEMBL21707326 0.85 PIM3 (0.34)
SCHEMBL25789941 0.85 RARB (0.47) RARBRARGRXRARARAABCB1
SCHEMBL23079184 0.84 PIM3 (0.34)
SCHEMBL22058735 0.84 PIM3 (0.32) RARBRARGRXRA

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
WO-2023124205-A1 ORGANIC COMPOUNDS, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2023-07-06 WO disclosed