SCHEMBL24627775

SCHEMBL24627775

NC(=O)CCCNC(=O)CCCCC1SCC2NC(=O)NC21

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.74
CA12 O43570 4/20 0.64
CA1 P00915 4/20 0.64
CA2 P00918 4/20 0.64
CA9 Q16790 4/20 0.64
PKM P14618 2/20 0.64
MEN1 O00255 1/20 0.64
ABL1 P00519 1/20 0.64
LMNA P02545 1/20 0.64
IDE P14735 1/20 0.64
MAPK1 P28482 1/20 0.64
KMT2A Q03164 1/20 0.64
RIN1 Q13671 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
PLCD1 P51178 1/20 0.57
HLCS P50747 1/20 0.56
F2 P00734 1/20 0.56
PRSS1 P07477 1/20 0.56
PRSS2 P07478 1/20 0.56
PRSS3 P35030 1/20 0.56

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
SCHEMBL8407567 0.97 TDP1 (0.76) TDP1CA12CA1CA2CA9
SCHEMBL5841368 0.97 TDP1 (0.76) TDP1CA12CA1CA2CA9
SCHEMBL13169001 0.97 TDP1 (0.76) TDP1CA12CA1CA2CA9
SCHEMBL24750115 0.97 TDP1 (0.76) TDP1CA12CA1CA2CA9
SCHEMBL19069314 0.97 TDP1 (0.76) TDP1CA12CA1CA2CA9
SCHEMBL31621058 0.97 TDP1 (0.76) TDP1CA12CA1CA2CA9
SCHEMBL18025829 0.97 TDP1 (0.76) TDP1CA12CA1CA2CA9
SCHEMBL19835759 0.95 TDP1 (0.70) TDP1CA12CA1CA2CA9
SCHEMBL8333056 0.94 TDP1 (0.73) TDP1CA12CA1CA2CA9
SCHEMBL30619601 0.94 TDP1 (0.69) TDP1CA12CA1CA2CA9

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-2022148457-A1 SUBSTITUTED SALICYLAMIDE COMPOUNDS AND USE THEREOF HELIOS HUAMING BIOPHARMA CO., LTD. (CN) 2022-07-14 WO disclosed