SCHEMBL9015537

SCHEMBL9015537

CCN(CC)C(=O)n1cnc(Sc2c(C)noc2C)n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 3/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
ALDH1A1 P00352 2/20 0.30
PKM P14618 1/20 0.30
PTBP1 P26599 1/20 0.30
P2RX1 P51575 1/20 0.30
P2RX3 P56373 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
P2RX7 Q99572 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
SCHEMBL5376215 0.87 BRD4 (0.32)
SCHEMBL9359912 0.79 LMNA (0.39) TDP1SMN1; SMN2
SCHEMBL7312272 0.78
SCHEMBL9378936 0.78 LMNA (0.36) P2RX4TDP1ALDH1A1PTBP1P2RX1
SCHEMBL9015556 0.78 POLB (0.41) RAB9ATDP1SMN1; SMN2NPSR1
SCHEMBL7660067 0.76 LMNA (0.37) P2RX4MEN1KMT2ATDP1ALDH1A1
SCHEMBL9015552 0.76 POLB (0.35) NPSR1
SCHEMBL8813071 0.74 PIK3CG (0.38) RAB9AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL9015559 0.73 ALDH1A1 (0.39) ALDH1A1NPSR1
SCHEMBL9491268 0.73 ALDH1A1 (0.40) P2RX4MEN1KMT2ATDP1ALDH1A1

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-5510320-A EXCELLENT CONTROL OF BLACKGRASS AND WILD OATS AND OTHER WEEDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-23 US disclosed
WO-1993009100-A1 HERBICIDAL TRIAZOLECARBOXAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-05-13 WO disclosed