SCHEMBL6608655

SCHEMBL6608655

CC(=O)Nc1ccc(Nc2cc(C)nc3ccc(N)cc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.59
LMNA P02545 1/20 0.59
NQO2 P16083 2/20 0.58
L3MBTL1 Q9Y468 3/20 0.56
MAPT P10636 4/20 0.54
NPC1 O15118 1/20 0.54
GUSB P08236 1/20 0.54
KMT2A Q03164 4/20 0.53
MITF O75030 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
GAA P10253 2/20 0.53
KDM4E B2RXH2 2/20 0.53
ATM Q13315 1/20 0.53
POLB P06746 1/20 0.51
RAD52 P43351 1/20 0.51
ALDH1A1 P00352 1/20 0.49
MAPK1 P28482 1/20 0.49
JAK2 O60674 1/20 0.49
PAX8 Q06710 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL6602513 0.84 KMT2A (0.50) HTTNQO2L3MBTL1MAPTNPC1
SCHEMBL9069887 0.82 L3MBTL1 (0.67) HTTLMNANQO2L3MBTL1MAPT
SCHEMBL27777741 0.81 DNMT1 (0.57) L3MBTL1MAPTKMT2ATDP1GAA
SCHEMBL21925700 0.80 HTT (0.66) HTTLMNAL3MBTL1MAPTNPC1
Hydrochloric Acid SCHEMBL1890853 0.80 DNMT1 (0.56) L3MBTL1MAPTKMT2ATDP1GAA
SCHEMBL20605601 0.78 HTT (0.52) HTTLMNAL3MBTL1MAPTNPC1
SCHEMBL5989371 0.78 TERT (0.60) HTTLMNAL3MBTL1MAPTNPC1
SCHEMBL21853342 0.77 ATM (0.67) HTTLMNANQO2MAPTKMT2A
SCHEMBL7763069 0.76 GNG2 (0.81) MAPTKMT2APOLBMAPK1MEN1
SCHEMBL13696892 0.76 KMT2A (0.55) LMNANQO2L3MBTL1MAPTNPC1

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
EP-1373252-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT Aventis Pharma S.A. (FR) 2004-01-02 EP disclosed
WO-2002076975-A1 CHEMICAL DERIVATIVES AND THEIR USE AS ANTI-TELOMERASE AGENT AVENTIS PHARMA S.A. (FR) 2002-10-03 WO disclosed