SCHEMBL8415336

SCHEMBL8415336

Cn1cc(CCC(Nc2cccnc2)OC(=O)/C=C\C(=O)OC(CCc2cn(C)c3ccccc23)Nc2cccnc2)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 3/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
HDAC3 O15379 3/20 0.39
HDAC4 P56524 3/20 0.39
HDAC1 Q13547 3/20 0.39
HDAC7 Q8WUI4 3/20 0.39
HDAC2 Q92769 3/20 0.39
HDAC8 Q9BY41 3/20 0.39
HDAC6 Q9UBN7 3/20 0.39
HDAC9 Q9UKV0 3/20 0.39
HDAC5 Q9UQL6 3/20 0.39
HDAC10 Q969S8 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
TP53 P04637 2/20 0.39
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL8416950 0.75 HTR2C (0.49) KDM4ELMNAHTTKMT2AMEN1
SCHEMBL8804198 0.74 NOTUM (0.62) KDM4EHPGDHSD17B10LMNAKMT2A
Fumaric Acid SCHEMBL8415339 0.74 MEN1 (0.48) KDM4EHPGDHSD17B10LMNAKMT2A
Maleic Acid SCHEMBL8415335 0.74 MEN1 (0.48) KDM4EHPGDHSD17B10LMNAKMT2A
SCHEMBL9056570 0.73 HTR2C (0.51) KDM4EHPGDHSD17B10LMNAKMT2A
SCHEMBL8804773 0.72 PTPN5 (0.64) KDM4ELMNAHTTKMT2AMEN1
SCHEMBL9054532 0.71 HTR2C (0.49) KDM4EHPGDHSD17B10LMNAKMT2A
SCHEMBL23927882 0.69 GPR84 (0.46) KDM4EHPGDHSD17B10LMNAKMT2A
SCHEMBL9165502 0.66 HTR2C (0.61) KDM4EHPGDHSD17B10KMT2AMEN1
SCHEMBL9055298 0.64 YES1 (0.65) KDM4EHPGDHSD17B10LMNAKMT2A

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
US-5965582-A ANTIHISTAMINES ASTA MEDICA AKTIENGESELLSCHAFT (DE) 1999-10-12 US disclosed