SCHEMBL28828623

SCHEMBL28828623

CC1(C)Cc2ccc(-c3ccc(Cl)cc3)cc2C1OC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.35
NTRK1 P04629 1/20 0.35
MET P08581 1/20 0.35
FGFR1 P11362 1/20 0.35
PRKACA P17612 1/20 0.35
KDR P35968 1/20 0.35
MAP2K2 P36507 1/20 0.35
FLT3 P36888 1/20 0.35
GSK3B P49841 1/20 0.35
MAP2K1 Q02750 1/20 0.35
MST1R Q04912 1/20 0.35
NTRK3 Q16288 1/20 0.35
NTRK2 Q16620 1/20 0.35
CAMK1D Q8IU85 1/20 0.35
TDP2 O95551 1/20 0.35
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 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
SCHEMBL28828541 0.91 PGR (0.36) ALOX5PTGS1SLC9A1PGR
SCHEMBL28828640 0.90 SIRT2 (0.36) TDP2PSEN1PSEN2APH1BNCSTN
SCHEMBL28828373 0.89 PGR (0.43) TDP2SLC9A1PGRSLC6A3
SCHEMBL28828603 0.89 PGR (0.40) PGRSLC6A3
SCHEMBL28828381 0.89 KIF11 (0.34) JAK2MEN1KMT2APGRJAK1
SCHEMBL29228288 0.88 PSEN1 (0.35) JAK2NTRK1METFGFR1PRKACA
SCHEMBL28950173 0.88 KLKB1 (0.36) HDAC1HDAC2PGR
SCHEMBL28950167 0.87 SLC9A1 (0.37) SLC9A1CNR2CNR1RAB9AHSD17B3
SCHEMBL28828437 0.86 PGR (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL28828684 0.84 KIF11 (0.43) TDP2PSEN1PSEN2APH1BNCSTN

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