SCHEMBL30935010

SCHEMBL30935010

CC1(C)OB(c2ccc3c(c2)CCCC3(F)F)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPL P06858 12/20 0.40
LIPG Q9Y5X9 12/20 0.40
ROCK1 Q13464 1/20 0.36
BACE1 P56817 4/20 0.35
P2RX7 Q99572 1/20 0.34
KDM1A O60341 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL10158676 1.00 LPL (0.40) LPLLIPGROCK1BACE1P2RX7
SCHEMBL31394725 0.91 LPL (0.41) LPLLIPGROCK1BACE1CA1
SCHEMBL10158552 0.90 LPL (0.41) LPLLIPGROCK1BACE1P2RX7
SCHEMBL2010946 0.85 LPL (0.39) LPLLIPGROCK1BACE1P2RX7
SCHEMBL24275634 0.81 LPL (0.41) LPLLIPGROCK1BACE1P2RX7
SCHEMBL31394797 0.81 LPL (0.42) LPLLIPGROCK1BACE1CA1
SCHEMBL5781980 0.80 LPL (0.46) LPLLIPGBACE1P2RX7CA1
SCHEMBL4158988 0.80 LPL (0.44) LPLLIPGROCK1BACE1P2RX7
SCHEMBL30284869 0.80 LPL (0.44) LPLLIPGROCK1BACE1P2RX7
SCHEMBL2011756 0.79 LPL (0.41) LPLLIPGROCK1BACE1CA1

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-2024125464-A1 TETRAHYDROISOQUINOLIN-ONE DERIVATIVES, PREPARATION METHODS AND MEDICINAL USES THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-06-20 WO disclosed