SCHEMBL30908654

SCHEMBL30908654

Cc1cc(Br)c2ccc(=O)[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
ADORA1 P30542 1/20 0.44
PDE3B Q13370 3/20 0.43
PDE3A Q14432 3/20 0.43
KDM4E B2RXH2 3/20 0.43
GLA P06280 2/20 0.43
GAA P10253 2/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
TNKS2 Q9H2K2 4/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
KIF11 P52732 1/20 0.39
LMNA P02545 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 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
SCHEMBL15448464 1.00 CA12 (0.46) CA12CA9ADORA1PDE3BPDE3A
SCHEMBL5993711 0.81 KDM4E (0.59) CA12CA9PDE3BPDE3AKDM4E
SCHEMBL2798796 0.79 KDM4E (0.58) PDE3BPDE3AKDM4EGLAGAA
SCHEMBL30908532 0.78 TNKS2 (0.46) CA12CA9ADORA1PDE3BPDE3A
SCHEMBL706680 0.78 PDE3B (0.43) ADORA1PDE3BPDE3AKDM4EGLA
SCHEMBL30908192 0.78 TP53 (0.51) CA12CA9ADORA1PDE3BPDE3A
SCHEMBL8873180 0.76 CA12 (0.56) CA12CA9ADORA1PDE3BPDE3A
SCHEMBL15448463 0.74 KDM4E (0.56) CA12CA9PDE3BPDE3AKDM4E
SCHEMBL30908311 0.74 AR (0.58)
SCHEMBL7265005 0.72 PDE3B (0.49) CA12CA9ADORA1PDE3BPDE3A

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-2024074611-A1 PRMT5 INHIBITORS Ryvu Therapeutics S.A. (PL) 2024-04-11 WO disclosed