SCHEMBL14355943

SCHEMBL14355943

CSc1ccccc1NC(=O)C#N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.56
▸ MEN1 O00255 5/20 0.56
▸ TP53 P04637 2/20 0.51
▸ POLB P06746 2/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ RAB9A P51151 4/20 0.51
▸ MAPT P10636 5/20 0.50
▸ SMN1; SMN2 Q16637 5/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ ALDH1A1 P00352 6/20 0.49
▸ TSHR P16473 1/20 0.49
▸ HPGD P15428 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ GAA P10253 1/20 0.47

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
SCHEMBL14444902 0.83 CETP (0.43) KMT2AMEN1NPSR1HSD17B10RAB9A
SCHEMBL6857302 0.79 KMT2A (0.65) KMT2AMEN1TP53POLBNPSR1
SCHEMBL13236107 0.78 RAB9A (0.62) POLBHSD17B10RAB9AMAPTNPC1
SCHEMBL5914915 0.78 DHODH (0.57) KMT2AMEN1TP53POLBNPSR1
SCHEMBL5914914 0.78 DHODH (0.57) KMT2AMEN1TP53POLBNPSR1
SCHEMBL4210466 0.77 KMT2A (0.62) KMT2AMEN1TP53POLBNPSR1
SCHEMBL4938228 0.77 KMT2A (0.62) KMT2AMEN1TP53POLBNPSR1
SCHEMBL29651063 0.77 KMT2A (0.62) KMT2AMEN1TP53POLBNPSR1
SCHEMBL2935482 0.77 KMT2A (0.68) KMT2AMEN1TP53POLBNPSR1
SCHEMBL27665991 0.77 KMT2A (0.62) KMT2AMEN1TP53POLBNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7297820-B2 Stilbene derivatives and their use for binding and imaging amyloid plaques TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2007-11-20 — — US disclosed
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