SCHEMBL9764617

SCHEMBL9764617

O=C1C=CC(=Cc2ccccc2)O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
ATM Q13315 1/20 0.51
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 4/20 0.46
HPGD P15428 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPT P10636 3/20 0.43
RECQL P46063 1/20 0.43
STK17B O94768 1/20 0.42
CYP1A2 P05177 2/20 0.41
F3 P13726 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 2/20 0.38
MITF O75030 1/20 0.38
NTSR1 P30989 1/20 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
SCHEMBL9764615 1.00 MEN1 (0.51) MEN1KMT2AATMALDH1A1KDM4E
SCHEMBL3224616 0.80 MEN1 (0.49) MEN1KMT2AATMKDM4ETDP1
SCHEMBL3224611 0.80 MEN1 (0.49) MEN1KMT2AATMKDM4ETDP1
SCHEMBL3224623 0.80 MEN1 (0.49) MEN1KMT2AATMKDM4ETDP1
SCHEMBL3215990 0.76 MEN1 (0.71) MEN1KMT2AATMALDH1A1KDM4E
SCHEMBL3224593 0.76 CYP1A2 (0.46) MEN1KMT2AATML3MBTL1CYP1A2
SCHEMBL3224600 0.76 CYP1A2 (0.46) MEN1KMT2AATML3MBTL1CYP1A2
(Z)-1,2-Diphenylethene SCHEMBL23274192 0.76 MAOB (0.46) MEN1KMT2AALDH1A1KDM4EHPGD
(Z)-1,2-Diphenylethene SCHEMBL23274191 0.76 MAOB (0.46) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL3221863 0.75 CISD1 (0.48) MEN1KMT2AATMMAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5066633-A Sensitizer for heat sensitive paper coatings GRAPHIC CONTROLS CORPORATION (US) 1991-11-19 US claimed
US-5066633-A Sensitizer for heat sensitive paper coatings GRAPHIC CONTROLS CORPORATION (US) 1991-11-19 US disclosed