SCHEMBL7065659

SCHEMBL7065659

CC(C)(CNC(=O)Nc1cccc2cccnc12)CC(=O)N(CC(=O)NO)CC1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.47
TDP1 Q9NUW8 2/20 0.41
POLB P06746 2/20 0.41
TRPV1 Q8NER1 1/20 0.40
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
MAPT P10636 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
HDAC3 O15379 1/20 0.38
HDAC2 Q92769 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
KDR P35968 1/20 0.38
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
MECP2 P51608 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
SCHEMBL6825098 0.98 HDAC1 (0.47) HDAC1TDP1POLBTRPV1CNR1
SCHEMBL7064899 0.88 OPRM1 (0.39) MAPTMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL7069145 0.88 P2RX7 (0.44) TRPV1CNR1CNR2MEN1KMT2A
SCHEMBL6824917 0.87 KDM4E (0.35) HDAC1
SCHEMBL6825473 0.87 HDAC6 (0.48) HDAC1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL6825358 0.84 HDAC1 (0.47) HDAC1TDP1POLBTRPV1CNR1
SCHEMBL6825347 0.83 HDAC1 (0.49) HDAC1TDP1POLBMAPTMEN1
SCHEMBL6822302 0.83 KMT2A (0.40) MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL6825944 0.83 KMT2A (0.43) HDAC1POLBMEN1KMT2AHDAC6
SCHEMBL6822311 0.83 NPC1 (0.40) HDAC1POLBHDAC6

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-2004087643-A1 DEFORMYLASE INHIBITOR, PROCESS FOR PREPARING THE SAME, AND ANTIBACTERIAL COMPOSITION COMPRISING THE SAME PROMEDITECH INC. (KR) 2004-10-14 WO disclosed