SCHEMBL8936562

SCHEMBL8936562

O=C(/C=C\C(=O)Oc1ccc(C=Cc2ccccc2)cc1)Oc1ccc(C=Cc2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.74
RAD51 Q06609 1/20 0.54
TRPA1 O75762 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 3/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC3 O15379 1/20 0.52
TNKS O95271 1/20 0.52
HDAC4 P56524 1/20 0.52
HCAR2 Q8TDS4 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
TNKS2 Q9H2K2 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52

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
SCHEMBL16982630 0.90 KMT2A (0.83) KMT2ASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL28903591 0.87 KMT2A (0.78) KMT2ASMN1; SMN2MAPTALDH1A1LMNA
Phenyl Cinnamate SCHEMBL1055161 0.86 KMT2A (0.77) KMT2ASMN1; SMN2MAPTALDH1A1LMNA
Phenyl Cinnamate SCHEMBL1055160 0.86 KMT2A (0.77) KMT2ASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL9248649 0.86 KMT2A (0.61) KMT2ARAD51TRPA1SMN1; SMN2MAPT
SCHEMBL27220137 0.85 KMT2A (1.00) KMT2ASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL21791873 0.85 KMT2A (1.00) KMT2ASMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL544695 0.85 KMT2A (0.60) KMT2ARAD51TRPA1SMN1; SMN2MAPT
SCHEMBL8836075 0.85 KMT2A (0.60) KMT2ARAD51TRPA1SMN1; SMN2MAPT
SCHEMBL8756097 0.84 KMT2A (0.73) KMT2ASMN1; SMN2MAPTALDH1A1LMNA

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
US-5482816-A RESISTS JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-01-09 US disclosed
US-5332650-A Resists JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1994-07-26 US disclosed