SCHEMBL6549435

SCHEMBL6549435

OC(CCCCn1ccc2ccc(Cl)cc21)n1ccc2ccc(Cl)cc21

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.55
KMO O15229 1/20 0.52
HTR7 P34969 2/20 0.43
MCL1 Q07820 2/20 0.42
PRMT5 O14744 1/20 0.41
CDK4 P11802 2/20 0.40
CCND1 P24385 2/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
HDAC6 Q9UBN7 3/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
OXER1 Q8TDS5 1/20 0.38
FFAR1 O14842 1/20 0.37
PPARG P37231 1/20 0.37

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
SCHEMBL9995332 0.77 KMO (0.59) ACLYKMOHTR7MCL1PRMT5
SCHEMBL8430623 0.74 KMO (0.59) ACLYKMOHTR7MCL1CDK4
SCHEMBL13668162 0.74 KMO (0.56) ACLYKMOHTR7MCL1PRMT5
SCHEMBL8430621 0.70 KMO (0.62) ACLYKMOHTR7MCL1PRMT5
SCHEMBL7676168 0.70 HTR2C (0.55) ACLYKMOHTR7PRMT5OXER1
SCHEMBL7676174 0.70 HTR2C (0.55) ACLYKMOHTR7PRMT5OXER1
SCHEMBL10311228 0.67 KMO (0.57) ACLYKMOHTR7MCL1PRMT5
SCHEMBL15723822 0.67 SLC6A2 (0.43) KMOHTR7PRMT5SLC6A2SLC6A4
SCHEMBL22421046 0.67 HTR7 (0.60) KMOHTR7
SCHEMBL24144837 0.66 HTR2C (0.58) KMOHTR7PRMT5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480966-A1 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES Exonhit Therapeutics S.A. (FR) 2004-12-01 EP disclosed
WO-2003074508-A1 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES EXONHIT THERAPEUTICS SA (FR) 2003-09-12 WO disclosed