SCHEMBL31184544

SCHEMBL31184544

Cc1cc(NCCN(C)C)cc2c1CN(C1CCC(C(=O)Nc3cc4ccccc4[nH]3)CC1)C2=O

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 1/20 0.36
▸ KCNH2 Q12809 2/20 0.35
▸ GHSR Q92847 2/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ SLC2A1 P11166 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TP53 P04637 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ VCP P55072 1/20 0.32
▸ PTGES O14684 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ ATAD2 Q6PL18 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ PIP5K1C O60331 1/20 0.31
▸ PIK3CA P42336 1/20 0.31

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
SCHEMBL31184828 0.82 CDK4 (0.41) HTR2CMAPTAHRSLC2A1TSHR
SCHEMBL31184822 0.81 CYP1A2 (0.42) KMT2ATP53LMNA
SCHEMBL31184992 0.81 MGLL (0.41) TSHRKMT2ALMNAPOLBKDM4E
SCHEMBL31184615 0.80 LMNA (0.31) LMNAPOLB
SCHEMBL31184614 0.80 ALDH1A1 (0.40) MAPTTSHRKMT2ATP53LMNA
SCHEMBL31184568 0.79 MAPK1 (0.32) TSHRPOLB
SCHEMBL31184642 0.79 ALDH1A1 (0.40) MAPTTP53POLBKDM4E
SCHEMBL31184767 0.79 MALT1 (0.45) MAPT
SCHEMBL31184750 0.79 BTK (0.34) —
SCHEMBL31185053 0.78 TP53 (0.40) MAPTKMT2ATP53LMNABRD4

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-2024220626-A1 SMALL MOLECULE MODULATORS OF OGG1 AZKARRA THERAPEUTICS, INC. (US) 2024-10-24 — — WO disclosed
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