SCHEMBL24374422

SCHEMBL24374422

Clc1ccc(C2=Cc3cc(Br)ccc3CC2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.36
CYP11B1 P15538 2/20 0.33
CYP19A1 P11511 1/20 0.33
KMT2A Q03164 3/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
MCL1 Q07820 2/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PTGS2 P35354 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TP53 P04637 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
PNMT P11086 1/20 0.32
ASIC3 Q9UHC3 1/20 0.32
DHODH Q02127 1/20 0.31
MEN1 O00255 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
SCHEMBL10402898 0.75 CYP11B1 (0.56) CYP11B2CYP11B1CYP19A1PTGS2SIGMAR1
SCHEMBL28654310 0.73 MAPT (0.51) KMT2ALMNAMAPTHPGDHTT
SCHEMBL23978339 0.70 PTGS2 (0.44) CYP11B2CYP11B1CYP19A1MAPTSMN1; SMN2
SCHEMBL6160676 0.70 PTGS2 (0.42) CYP11B2CYP11B1CYP19A1KMT2AMAPT
SCHEMBL5864919 0.69 HTR2A (0.38) HTTPNMTHTR2C
SCHEMBL2967620 0.69 TRPA1 (0.45) CYP11B2CYP11B1CYP19A1PTGS2TDP1
SCHEMBL30957748 0.68 ESR2 (0.45) CYP11B2CYP11B1CYP19A1
SCHEMBL30957747 0.68 ESR2 (0.45) CYP11B2CYP11B1CYP19A1
SCHEMBL38662063 0.66 TDP1 (0.38) CYP11B2CYP11B1CYP19A1TDP1L3MBTL1
SCHEMBL15775125 0.64 SRD5A1 (0.46) KMT2ASMN1; SMN2TDP1L3MBTL1PNMT

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-2022086297-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-04-28 WO disclosed