SCHEMBL6847129

SCHEMBL6847129

COc1ccc2c(n1)C(=O)C=C(Nc1ccccc1C(C)=O)C2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.44
CASP3 P42574 5/20 0.44
SENP8 Q96LD8 5/20 0.44
SENP7 Q9BQF6 5/20 0.44
SENP6 Q9GZR1 5/20 0.44
APAF1 O14727 5/20 0.44
MAPT P10636 5/20 0.44
HKDC1 Q2TB90 3/20 0.44
KDM4E B2RXH2 3/20 0.44
TDP2 O95551 3/20 0.44
RXFP1 Q9HBX9 1/20 0.44
SAE1 Q9UBE0 1/20 0.44
UBA2 Q9UBT2 1/20 0.44
STAT3 P40763 2/20 0.40
MEN1 O00255 7/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ALDH1A1 P00352 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 2/20 0.38

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
SCHEMBL6350632 0.77 MAPT (0.59) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL6845721 0.72 STAT3 (0.43) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL6846968 0.71 KMT2A (0.44) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL6841572 0.71 KMT2A (0.50) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL3273068 0.67 APAF1 (0.72) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL6841492 0.67 KMT2A (0.53) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL6841545 0.67 KMT2A (0.53) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL6845567 0.65 KMT2A (0.51) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL25449209 0.65 AKR1C3 (0.66) KMT2AMAPTKDM4EMEN1ALDH1A1
SCHEMBL17449178 0.64 POLB (0.50) KMT2AMAPTKDM4EMEN1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202992-B1 ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS CEPHALON FRANCE (FR) 2004-09-15 EP disclosed
EP-1202992-A2 ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS LABORATOIRE L. LAFON (FR) 2002-05-08 EP disclosed
WO-2001012631-A2 ASCIDIDEMIN DERIVATIVES AND THEIR THERAPEUTIC APPLICATIONS LABORATOIRE L. LAFON (FR) 2001-02-22 WO disclosed