SCHEMBL30710364

SCHEMBL30710364

COC(=O)c1ccc2c(c1)C(c1ccccc1)NC2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
TSHR P16473 1/20 0.45
KIF11 P52732 1/20 0.43
TRPA1 O75762 2/20 0.42
GRIN2B Q13224 1/20 0.42
EGFR P00533 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
BCL2 P10415 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41

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
SCHEMBL30710370 0.88 MEN1 (0.65) KMT2AMEN1MAPKAPK2KDM1A
SCHEMBL27276907 0.80 MEN1 (0.65) KMT2AMEN1CHRNB2CHRNA4CA1
SCHEMBL30734291 0.80 MEN1 (0.65) KMT2AMEN1CHRNB2CHRNA4CA1
SCHEMBL30710343 0.80 CHRNB2 (0.44) KMT2AMEN1TSHRKIF11GRIN2B
SCHEMBL30710485 0.80 CHRNB2 (0.44) KMT2AMEN1TSHRKIF11GRIN2B
SCHEMBL29557450 0.76 MEN1 (0.41) KMT2AMEN1TSHRKIF11TRPA1
SCHEMBL17971658 0.76 MEN1 (0.41) KMT2AMEN1TSHRKIF11TRPA1
SCHEMBL28697343 0.76 MEN1 (0.41) KMT2AMEN1TSHRKIF11TRPA1
SCHEMBL22784451 0.76 MEN1 (0.65) KMT2AMEN1MAPKAPK2CA1CA2
SCHEMBL29560484 0.76 MEN1 (0.65) KMT2AMEN1MAPKAPK2CA1CA2

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
WO-2023250439-A1 TREX1 INHIBITORS AND USES THEREOF TEMPEST THERAPEUTICS, INC. (US) 2023-12-28 WO disclosed