SCHEMBL28034394

SCHEMBL28034394

CCc1ccc(C(=O)CC(=O)Nc2ccc(O)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.61
MEN1 O00255 5/20 0.61
ATM Q13315 2/20 0.61
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
RAB9A P51151 3/20 0.51
GAA P10253 2/20 0.50
HPGD P15428 2/20 0.50
ALDH1A1 P00352 2/20 0.50
APAF1 O14727 1/20 0.50
USP2 O75604 1/20 0.50

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
SCHEMBL16610194 0.82 DEGS1 (0.61) KMT2AMEN1RAB9AGAAHPGD
SCHEMBL3166771 0.82 SMN1; SMN2 (0.69) KMT2AMEN1ATMHDAC3HDAC4
SCHEMBL9312728 0.81 HDAC3 (0.66) KMT2AMEN1ATMHDAC3HDAC4
SCHEMBL9508626 0.80 KMT2A (0.63) KMT2AMEN1RAB9AGAAHPGD
SCHEMBL4112929 0.80 RAB9A (0.69) KMT2AMEN1ATMRAB9AGAA
SCHEMBL4866611 0.77 ALDH1A1 (0.64) KMT2AMEN1ATMRAB9AGAA
SCHEMBL20851771 0.76 POLB (0.74) KMT2AMEN1ATMHDAC3HDAC4
SCHEMBL13381412 0.76 HDAC3 (0.60) KMT2AMEN1ATMHDAC3HDAC4
SCHEMBL7055067 0.76 POLB (0.70) KMT2AMEN1ATMHDAC3HDAC4
SCHEMBL826066 0.76 HDAC3 (0.64) KMT2AMEN1ATMHDAC3HDAC4

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
CN-105085433-B Substituted amide phenol compound and preparation method thereof, pharmaceutical composition and purposes 中国科学院上海药物研究所 2019-06-25 CN disclosed
CN-105085433-A Substituted-amide phenolic compound, preparation method, pharmaceutical composition and application thereof SHANGHAI INST MATERIA MEDICA 2015-11-25 CN disclosed