SCHEMBL28684392

SCHEMBL28684392

Cc1ccc(N(C)c2ccc(C)cc2C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.50
ALDH1A1 P00352 3/20 0.42
NOTUM Q6P988 1/20 0.42
MCL1 Q07820 3/20 0.42
LTC4S Q16873 1/20 0.41
KEAP1 Q14145 4/20 0.41
NFE2L2 Q16236 4/20 0.41
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ABCC1 P33527 1/20 0.39
GFER P55789 1/20 0.39
AKR1C3 P42330 1/20 0.39
METAP2 P50579 1/20 0.38

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
SCHEMBL28286414 0.92 CSNK2A1 (0.49) CSNK2A1ALDH1A1LTC4SMEN1KMT2A
SCHEMBL29290222 0.89 CSNK2A1 (0.44) CSNK2A1ALDH1A1NOTUMMCL1LTC4S
SCHEMBL28667224 0.87 KEAP1 (0.44) CSNK2A1ALDH1A1NOTUMMCL1LTC4S
SCHEMBL28284904 0.87 PLG (0.42) CSNK2A1ALDH1A1MCL1LTC4SKEAP1
SCHEMBL28492956 0.85 AKR1C3 (0.50) ALDH1A1MCL1KEAP1NFE2L2SMN1; SMN2
SCHEMBL28281091 0.83 AKR1C3 (0.50) ALDH1A1LTC4SSMN1; SMN2AKR1C3
SCHEMBL19689021 0.82 ALDH1A1 (0.57) CSNK2A1ALDH1A1NOTUMMCL1SMN1; SMN2
SCHEMBL28706175 0.79 CSNK2A1 (0.53) CSNK2A1ALDH1A1NOTUMMCL1SMN1; SMN2
SCHEMBL28286413 0.78 MEN1 (0.45) CSNK2A1ALDH1A1NOTUMLTC4SNFE2L2
SCHEMBL28173394 0.77 CSNK2A1 (0.52) CSNK2A1ALDH1A1NOTUMMCL1SMN1; SMN2

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-109516946-B Method for preparing carbazole compound 上海交通大学 2022-01-11 CN disclosed