SCHEMBL7781365

SCHEMBL7781365

C=CC=CC1=Nc2c(ccc3ccccc23)C1(C)C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
THRB P10828 2/20 0.32
PKM P14618 1/20 0.32
ALOX12 P18054 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL4856328 0.72 MEN1 (0.56) MEN1KMT2AKDM4EMAPTTHRB
Iodide SCHEMBL29763642 0.71 MEN1 (0.54) MEN1KMT2AKDM4EMAPTTHRB
SCHEMBL28795459 0.67 KMT2A (0.49) MEN1KMT2AKDM4EMAPTTHRB
SCHEMBL17067963 0.63 CYP2A6 (0.47) MEN1KMT2AKDM4EMAPTL3MBTL1
SCHEMBL25464150 0.63 CYP2A6 (0.47) MEN1KMT2AKDM4EMAPTL3MBTL1
SCHEMBL30493441 0.61 RXRA (0.50) KDM4EMAPTSMN1; SMN2LMNA
SCHEMBL490085 0.61 RXRA (0.50) KDM4EMAPTSMN1; SMN2LMNA
SCHEMBL490083 0.61 RXRA (0.50) KDM4EMAPTSMN1; SMN2LMNA
SCHEMBL1499911 0.61 KDM4E (0.47) MEN1KMT2AKDM4EMAPTTHRB
Phenanthrene SCHEMBL2963532 0.61 ALDH1A1 (0.71) THRBTDP1

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
JP-2001323179-A CYANINE COLORING MATTER HAYASHIBARA BIOCHEM LAB INC 2001-11-20 JP disclosed