SCHEMBL28828648

SCHEMBL28828648

CCC1(CC)Cc2cc(-c3cccc(OC)c3OC)ccc2C1OC(N)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.37
CTSA P10619 1/20 0.37
ABCB1 P08183 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA2B P29275 1/20 0.36
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
PRKAB2 O43741 1/20 0.35
PRKAG1 P54619 1/20 0.35
PRKAA2 P54646 1/20 0.35
PRKAA1 Q13131 1/20 0.35
PRKAG3 Q9UGI9 1/20 0.35
PRKAG2 Q9UGJ0 1/20 0.35
PRKAB1 Q9Y478 1/20 0.35
ICMT O60725 1/20 0.35
GLA P06280 1/20 0.34
GAA P10253 1/20 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
SCHEMBL28828760 0.88 ABL1 (0.35) CTSA
SCHEMBL28828528 0.87 ADORA3 (0.38) FFAR4CTSAABCB1ADORA3ADORA2A
SCHEMBL28828421 0.85 PDE4B (0.40) KDM4EALDH1A1HPGDGAAMAPT
SCHEMBL28828587 0.85 CYP1A1 (0.42) CTSAABCB1KDM4ESMN1; SMN2
SCHEMBL28828711 0.84 TDP2 (0.43) CTSAABCB1ADORA3KDM4EHSD17B10
SCHEMBL29228205 0.83 ABCB1 (0.39) FFAR4CTSAABCB1ADORA3ADORA2A
SCHEMBL28828554 0.81 F2 (0.41) FFAR4EDNRBEDNRANAAA
SCHEMBL28828756 0.81 CHRNB2 (0.39) KDM4EALDH1A1HSD17B10HPGDEDNRB
SCHEMBL28828407 0.80 RXRA (0.36) FFAR4ABCB1
SCHEMBL27212722 0.80 FFAR4 (0.39) FFAR4CTSAABCB1ADORA3ADORA2A

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
CN-114829361-B Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-16 CN claimed
CN-114829361-A Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing same 柳韩洋行 2022-07-29 CN claimed
CN-114829361-B Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-16 CN disclosed
CN-114829361-A Derivatives having 2, 3-dihydro-1H-indene or 2, 3-dihydrobenzofuran moiety or pharmaceutically acceptable salts thereof and pharmaceutical compositions containing same 柳韩洋行 2022-07-29 CN disclosed