SCHEMBL6426709

SCHEMBL6426709

COn1c(C(C)=O)c(CCNF)c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 1/20 0.43
▸ MTNR1A P48039 4/20 0.38
▸ MTNR1B P49286 4/20 0.38
▸ EGFR P00533 1/20 0.38
▸ FOLH1 Q04609 2/20 0.37
▸ MCL1 Q07820 2/20 0.36
▸ BCL2 P10415 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ TSHR P16473 2/20 0.35
▸ F2 P00734 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ NR4A2 P43354 1/20 0.35

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
SCHEMBL6426651 0.88 GFER (0.44) GFERMTNR1AMTNR1BEGFRFOLH1
SCHEMBL6425982 0.88 GFER (0.39) GFERMTNR1AMTNR1BEGFRFOLH1
SCHEMBL27673202 0.74 MCL1 (0.48) EGFRFOLH1MCL1BCL2KMT2A
SCHEMBL28306102 0.71 GFER (0.51) GFERMTNR1AMTNR1BLMNAMAPT
SCHEMBL28665614 0.71 MEN1 (0.44) FOLH1MCL1BCL2SMN1; SMN2KMT2A
SCHEMBL25292726 0.68 IL1R1 (0.42) GFEREGFRFOLH1MCL1SMN1; SMN2
SCHEMBL3338156 0.67 OXER1 (0.42) TSHR
SCHEMBL27818093 0.67 EGFR (0.57) EGFRSMN1; SMN2LMNATSHRMAPT
SCHEMBL4073890 0.66 IL1R1 (0.43) SMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL9987688 0.65 TSHR (0.42) EGFRSMN1; SMN2KMT2ATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212056-B1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES US GOV HEALTH & HUMAN SERV (US) 2005-12-07 — — EP claimed
EP-1212056-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES The Government of the United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2002-06-12 — — EP claimed
US-20020002144-A1 Methods and compositions for bisubstrate inhibitors of acetyltransferases THE GOVERNMENT OF THE UNITED STATES OF AMERICA, DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2002-01-03 — — US claimed
WO-2001012185-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-02-22 — — WO claimed
EP-1212056-B1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES US GOV HEALTH & HUMAN SERV (US) 2005-12-07 — — EP disclosed
EP-1212056-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES The Government of the United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2002-06-12 — — EP disclosed
US-20020002144-A1 Methods and compositions for bisubstrate inhibitors of acetyltransferases THE GOVERNMENT OF THE UNITED STATES OF AMERICA, DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2002-01-03 — — US disclosed
WO-2001012185-A1 METHODS AND COMPOSITIONS FOR BISUBSTRATE INHIBITORS OF ACETYLTRANSFERASES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-02-22 — — WO disclosed
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