SCHEMBL9508883

SCHEMBL9508883

CC(C)CNC(=O)c1ccc2ccccc2c1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.56
KMT2A Q03164 7/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
KDM4A O75164 1/20 0.55
CTDSP1 Q9GZU7 1/20 0.55
KDM4C Q9H3R0 1/20 0.55
LDHA P00338 1/20 0.54
KDM4E B2RXH2 3/20 0.54
MAPT P10636 2/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.54
MAOB P27338 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
PSEN1 P49768 1/20 0.51
PSEN2 P49810 1/20 0.51
APH1B Q8WW43 1/20 0.51
NCSTN Q92542 1/20 0.51
APH1A Q96BI3 1/20 0.51
PSENEN Q9NZ42 1/20 0.51

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
SCHEMBL163633 0.87 KMT2A (0.54) MEN1KMT2ASMN1; SMN2KDM4ACTDSP1
SCHEMBL16866255 0.84 PLK1 (0.60) MEN1KMT2ASMN1; SMN2MAOBNPC1
SCHEMBL161942 0.83 KMT2A (0.51) MEN1KMT2ASMN1; SMN2KDM4EMAPT
SCHEMBL11507636 0.82 LDHA (0.62) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL4626021 0.80 MEN1 (0.56) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL7192236 0.79 PLK1 (0.66) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL11314751 0.79 KDM4E (0.49) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL9400432 0.78 EGLN1 (0.66) MEN1KMT2ALDHAKDM4EMAPT
SCHEMBL7514107 0.78 HTT (0.64) MEN1KMT2AKDM4ACTDSP1KDM4C
SCHEMBL162648 0.77 KMT2A (0.51) MEN1KMT2ASMN1; SMN2KDM4EMAPT

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-0384990-B1 CYAN DYES IN DYE-DONOR ELEMENTS FOR USE IN THERMAL DYE TRANSFER METHODS AGFA-GEVAERT N.V. (BE) 1993-07-28 EP disclosed
US-4987119-A DERIVATIVE OF NAPHTHO-INDOANILINE AGFA-GEVAERT, N.V. (BE) 1991-01-22 US disclosed
EP-0384990-A1 Cyan dyes in dye-donor elements for use in thermal dye transfer methods AGFA-GEVAERT N.V. (BE) 1990-09-05 EP disclosed