SCHEMBL11383936

SCHEMBL11383936

COc1cc(N)c(C)cc1NC1=CC(=O)C(N)=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ APAF1 O14727 1/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ PAX8 Q06710 1/20 0.39
▸ SENP8 Q96LD8 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 1/20 0.39
▸ GAA P10253 3/20 0.35
▸ POLB P06746 2/20 0.35
▸ GFER P55789 1/20 0.35
▸ KDR P35968 8/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ MAPT P10636 2/20 0.32
▸ GLA P06280 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL10787660 0.83 MEN1 (0.37) MEN1KMT2AAPAF1CASP3PAX8
SCHEMBL17745050 0.80 CASP3 (0.37) MEN1KMT2AAPAF1CASP3PAX8
SCHEMBL11392957 0.79 MAPT (0.40) MEN1KMT2AAPAF1CASP3PAX8
SCHEMBL15039274 0.79 KDR (0.38) MEN1KMT2AAPAF1CASP3PAX8
SCHEMBL11387255 0.77 — —
SCHEMBL15020242 0.76 KDR (0.34) MEN1KMT2AAPAF1CASP3PAX8
SCHEMBL11789530 0.67 BRD4 (0.47) MEN1KMT2AGAAPOLBGFER
SCHEMBL6815196 0.67 MEN1 (0.51) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL11391477 0.66 MAPT (0.35) MEN1KMT2AGAAPOLBMAPT
SCHEMBL1916068 0.65 MEN1 (0.38) MEN1KMT2AAPAF1CASP3PAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4260749-A HAIR DYES L'OREAL (FR) 1981-04-07 — — US disclosed
US-4204059-A HAIR DYES L'OREAL (FR) 1980-05-20 — — US disclosed
US-4084052-A HAIR DYES L'OREAL (FR) 1978-04-11 — — US disclosed
US-4023926-A Diaminobenzoquinones in hair dye compositions SOCIETE ANONYME DITE: L'OREAL (FR) 1977-05-17 — — US disclosed
Send feedback