SCHEMBL9117935

SCHEMBL9117935

CCOc1ccc(OC(=O)C2CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.61
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
USP2 O75604 1/20 0.54
TP53 P04637 1/20 0.54
TSHR P16473 1/20 0.54
ELANE P08246 2/20 0.54
PKM P14618 1/20 0.51
NQO1 P15559 1/20 0.50
PARP10 Q53GL7 1/20 0.49
MEN1 O00255 1/20 0.48
ACACB O00763 2/20 0.48
HPGD P15428 1/20 0.48
LMNA P02545 1/20 0.48
F2 P00734 1/20 0.47
POLB P06746 1/20 0.46
NPC1 O15118 1/20 0.46
PLK1 P53350 1/20 0.46

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
SCHEMBL18417199 1.00 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL12444455 0.94 KMT2A (0.54) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL11642256 0.93 KMT2A (0.68) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL1895159 0.92 KMT2A (0.53) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL18551974 0.92 KMT2A (0.66) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL11404207 0.89 KMT2A (0.50) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL7763807 0.89 KMT2A (0.50) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL2213018 0.89 KMT2A (0.50) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL13271014 0.88 KMT2A (0.49) KMT2AHTTSMN1; SMN2TDP1USP2
SCHEMBL11412276 0.88 KMT2A (0.49) KMT2AHTTSMN1; SMN2TDP1USP2

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
WO-1995028410-A1 BIOLOGICALLY ACTIVE COMPOSITION HENKEL CORPORATION (US) 1995-10-26 WO disclosed