SCHEMBL7555285

SCHEMBL7555285

O=C1CCCc2[nH]c3c(F)cccc3c21.O=C1CCCc2c1c1cccc(F)c1n2Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.49
CSNK2A2 P19784 2/20 0.44
CSNK2B P67870 2/20 0.44
CSNK2A1 P68400 2/20 0.44
ABCG2 Q9UNQ0 2/20 0.44
FABP4 P15090 8/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
HPGD P15428 1/20 0.41
FABP3 P05413 3/20 0.40
BRD4 O60885 1/20 0.38
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL6921111 0.89 CSNK2A2 (0.53) CSNK2A2CSNK2BCSNK2A1ABCG2FABP4
SCHEMBL6924568 0.82 FABP4 (0.51) CSNK2A2CSNK2BCSNK2A1ABCG2FABP4
SCHEMBL5830904 0.80 DYRK1A (0.68) DYRK1ABRD4
SCHEMBL6925034 0.77 CSNK2A2 (0.54) DYRK1ACSNK2A2CSNK2BCSNK2A1ABCG2
SCHEMBL6925466 0.76 ATM (0.55) CSNK2A2CSNK2BCSNK2A1ABCG2FABP4
SCHEMBL6691727 0.74 FABP4 (0.74) CSNK2A2CSNK2BCSNK2A1ABCG2FABP4
SCHEMBL6923369 0.72 FABP4 (0.50) DYRK1ACSNK2A2CSNK2BCSNK2A1ABCG2
SCHEMBL6685674 0.72 FABP4 (0.74) FABP4FABP3
SCHEMBL30480036 0.72 HDAC1 (0.70) CSNK2A2CSNK2BCSNK2A1ABCG2HDAC1
SCHEMBL6925178 0.72 HDAC1 (0.70) CSNK2A2CSNK2BCSNK2A1ABCG2HDAC1

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-1210329-A2 AMINOALKOXY CARBAZOLES AND THEIR USE AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2002-06-05 EP disclosed
WO-2001017963-A2 AMINOALKOXY CARBAZOLES AND THEIR USE AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2001-03-15 WO disclosed