SCHEMBL29024640

SCHEMBL29024640

CC(C)COc1ccc(Cn2cc(Cc3ccccc3)c(C3CCNCC3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.39
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
LMNA P02545 1/20 0.38
HTR2C P28335 1/20 0.37
PDE6D O43924 4/20 0.37
FAAH O00519 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LTA4H P09960 2/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
MDM2 Q00987 1/20 0.36
MCL1 Q07820 1/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
PRMT5 O14744 2/20 0.35
HTR2A P28223 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL29024485 0.89 NPC1 (0.39) LMNAFAAHMEN1KMT2ALTA4H
SCHEMBL30478090 0.80 FAAH (0.37) HRH1LMNAFAAHMEN1KMT2A
SCHEMBL29024639 0.78 SLC16A3 (0.41) HRH1GABRA1GABRB2PDE6DFAAH
SCHEMBL7552154 0.78 GABRA1 (0.48) HRH1GABRA1GABRB2HTR2CSLC6A2
SCHEMBL29024487 0.78 HRH1 (0.40) HRH1GABRA1GABRB2PDE6DFAAH
SCHEMBL30480300 0.70 LMNA (0.41) HRH1LMNAMEN1KMT2ALTA4H
SCHEMBL29024483 0.70 LMNA (0.40) LMNAFAAHMEN1KMT2ALTA4H
SCHEMBL29024489 0.67 ABL1 (0.39) PRMT5HTR2A
SCHEMBL29024635 0.67 TP53 (0.39) LMNAFAAHLTA4HMAPTPRMT5
SCHEMBL8504734 0.67 PRMT5 (0.49) HTR2CSLC6A2SLC6A4SLC6A3PRMT5

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
CN-116354925-A Pyrazole derivatives and use thereof 江苏恩华药业股份有限公司 2023-06-30 CN disclosed