SCHEMBL8723682

SCHEMBL8723682

O=C(O)C1(c2ccc[nH]2)C=CC=N1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 1/20 0.33
KDM4C Q9H3R0 1/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.31
TSHR P16473 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
SCHEMBL21693732 0.86
SCHEMBL28500674 0.69
SCHEMBL15380747 0.65 TDP1 (0.33) MAPTTSHR
SCHEMBL9373314 0.59 NAPRT (0.35) NAPRTMAPTKDM4EGAARAB9A
Toluene SCHEMBL19690594 0.58 LMNA (0.39) MAPTRAB9ATSHR
SCHEMBL6675177 0.58
SCHEMBL3128160 0.56
SCHEMBL9727935 0.55
SCHEMBL16794593 0.54 NAPRT (0.52) NAPRTKDM4EGAARAB9ATSHR
SCHEMBL28649306 0.54

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-5736518-A Peptide compounds of (L) amino acids and ring molecules, and therapeutical applications thereof POLIFARMA S.P.A. (IT) 1998-04-07 US disclosed
US-5504071-A HYPOTENSIVE AGENTS POLIFARMA S.P.A. (IT) 1996-04-02 US disclosed