SCHEMBL7915249

SCHEMBL7915249

O=C(Nc1ccccc1)c1ccc2c(c1)C(=O)NC2=O

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 3/20 0.63
RXFP1 Q9HBX9 2/20 0.62
KMT2A Q03164 10/20 0.61
MEN1 O00255 6/20 0.61
CTDSP1 Q9GZU7 2/20 0.58
BACE1 P56817 2/20 0.56
POLB P06746 1/20 0.56
PKM P14618 1/20 0.55
GSK3B P49841 1/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53
LMNA P02545 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL14235295 0.88 CASP3 (0.57) CASP3RXFP1KMT2AMEN1CTDSP1
SCHEMBL6264128 0.84 CASP3 (0.86) CASP3RXFP1KMT2AMEN1CTDSP1
SCHEMBL24320985 0.84 KMT2A (0.60) CASP3RXFP1KMT2AMEN1CTDSP1
SCHEMBL24320986 0.84 KMT2A (0.60) CASP3RXFP1KMT2AMEN1CTDSP1
SCHEMBL24320987 0.83 RXFP1 (0.64) CASP3RXFP1KMT2AMEN1CTDSP1
SCHEMBL29355347 0.81 NR1H4 (0.64) RXFP1KMT2AMEN1NPC1LMNA
SCHEMBL6264004 0.80 KMT2A (0.76) CASP3RXFP1KMT2AMEN1CTDSP1
SCHEMBL5639582 0.79 CASP3 (0.66) CASP3RXFP1KMT2AMEN1POLB
SCHEMBL30949348 0.79 GSK3B (0.67) CASP3RXFP1KMT2AMEN1CTDSP1
SCHEMBL31680603 0.79 MAPT (0.58) CASP3RXFP1KMT2AMEN1CTDSP1

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-6221877-B1 IN PARTICULAR BOVINE TRICHOMONIASIS AND GIARDIASIS REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-04-24 US disclosed
US-6221877-B1 IN PARTICULAR BOVINE TRICHOMONIASIS AND GIARDIASIS REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-04-24 US disclosed