SCHEMBL7466491

SCHEMBL7466491

Cc1cc2c(cc1-c1ccc(CN3C(=O)CSC3=O)cc1C(F)(F)F)C(C)(C)CCC2(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
ALDH1A1 P00352 1/20 0.40
KCNN4 O15554 9/20 0.40
RXRA P19793 4/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
AR P10275 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
RARB P10826 1/20 0.35
RARG P13631 1/20 0.35
PPARG P37231 1/20 0.35
PIM1 P11309 1/20 0.34

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
SCHEMBL7458454 0.92 POLB (0.43) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7460353 0.89 GSK3A (0.48) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7463053 0.86 POLB (0.43) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7463442 0.86 ALDH1A1 (0.46) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7464315 0.86 GSK3A (0.45) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7459610 0.86 KCNN4 (0.43) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7459796 0.85 POLB (0.45) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7464561 0.85 GSK3A (0.47) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7461714 0.85 GSK3A (0.44) POLBGSK3AGSK3BALDH1A1KCNN4
SCHEMBL7470275 0.84 KMT2A (0.43) POLBGSK3AGSK3BALDH1A1KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1214305-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION Maxia Pharmaceuticals, Inc. (US) 2002-06-19 EP claimed
WO-2001016123-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION MAXIA PHARMACEUTICALS, INC. (US) 2001-03-08 WO claimed
EP-1214305-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION Maxia Pharmaceuticals, Inc. (US) 2002-06-19 EP disclosed
WO-2001016123-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION MAXIA PHARMACEUTICALS, INC. (US) 2001-03-08 WO disclosed