SCHEMBL2963557

SCHEMBL2963557

CCOC(=O)CCc1cc(C(=O)c2ccc(OCC(C)C)cc2O)ccc1OCc1ccc(C(=O)NO)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JUN P05412 3/20 0.47
FOS P01100 2/20 0.47
HPGD P15428 1/20 0.42
UGT1A1 P22309 1/20 0.41
UGT1A3 P35503 1/20 0.41
UGT1A8 Q9HAW9 1/20 0.41
HDAC1 Q13547 7/20 0.38
HDAC2 Q92769 5/20 0.38
SMPD1 P17405 5/20 0.38
HDAC8 Q9BY41 3/20 0.37
HDAC6 Q9UBN7 3/20 0.37
HDAC3 O15379 1/20 0.37
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
HDAC4 P56524 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 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
SCHEMBL4291386 0.85 JUN (0.52) JUNFOSHPGDUGT1A1UGT1A3
SCHEMBL2960328 0.84 JUN (0.59) JUNFOSHPGDUGT1A1UGT1A3
SCHEMBL2959153 0.84 JUN (0.54) JUNFOSHPGDUGT1A1UGT1A3
SCHEMBL2954291 0.83 JUN (0.50) JUNFOSUGT1A1UGT1A3UGT1A8
SCHEMBL4285838 0.83 JUN (0.52) JUNFOSHPGDUGT1A1UGT1A3
SCHEMBL4276443 0.82 FOS (0.62) JUNFOSHPGD
SCHEMBL4277010 0.82 JUN (0.61) JUNFOSHPGDUGT1A1UGT1A3
SCHEMBL2968375 0.81 JUN (0.61) JUNFOSHPGDUGT1A1UGT1A3
SCHEMBL4280879 0.81 FOS (0.62) JUNFOSHPGD
SCHEMBL2967371 0.80 JUN (0.48) JUNFOSHPGDUGT1A1UGT1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1445249-B1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-07 EP disclosed
US-7772285-B2 Benzophenone derivatives or salts thereof TOYAMA CHEMICAL CO., LTD. (JP) 2010-08-10 US disclosed
EP-1445249-A1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2004-08-11 EP disclosed