SCHEMBL9861664

SCHEMBL9861664

CC(=O)Nc1cccc2c1C(=O)c1cccc(N)c1C2=O.Nc1cccc2c1C(=O)c1cccc(NC(=O)c3ccccc3)c1C2=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
MMP14 P50281 1/20 0.64
MAOA P21397 1/20 0.64
CASP3 P42574 3/20 0.56
HDAC2 Q92769 5/20 0.55
HDAC3 O15379 2/20 0.55
HDAC1 Q13547 2/20 0.55
MAPK1 P28482 1/20 0.55
ADORA2A P29274 1/20 0.48
NCOR2 Q9Y618 1/20 0.47
CCNE2 O96020 3/20 0.46
CCNE1 P24864 3/20 0.46
CDK2 P24941 3/20 0.46
POLB P06746 2/20 0.46
CCR6 P51684 1/20 0.46
BLM P54132 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46

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
SCHEMBL30611003 0.94 MEN1 (0.72) MEN1KMT2AMMP14MAOACASP3
SCHEMBL1982461 0.94 MEN1 (0.72) MEN1KMT2AMMP14MAOACASP3
SCHEMBL8777783 0.90 MEN1 (0.67) MEN1KMT2AMMP14MAOACASP3
SCHEMBL31040609 0.89 MAOA (0.74) MEN1KMT2AMMP14MAOACASP3
SCHEMBL8777843 0.89 MAOA (0.74) MEN1KMT2AMMP14MAOACASP3
SCHEMBL31040610 0.89 MAOA (0.74) MEN1KMT2AMMP14MAOACASP3
SCHEMBL11841448 0.87 MEN1 (0.80) MEN1KMT2AMMP14MAOACASP3
SCHEMBL2877019 0.85 CASP3 (0.73) MEN1KMT2AMMP14MAOACASP3
SCHEMBL30111337 0.85 CASP3 (0.73) MEN1KMT2AMMP14MAOACASP3
SCHEMBL29607631 0.85 CASP3 (0.73) MEN1KMT2AMMP14MAOACASP3

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-5026831-A Water-insoluble disazo colorants having hetero-bicyclic methylene-active compounds as coupling component HOECHST AKTIENGESELLSCHAFT (DE) 1991-06-25 US disclosed