SCHEMBL24159985

SCHEMBL24159985

CNC(=O)CCC(C=O)N1Cc2c(SCCCCCN3CCOCC3)cccc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ THRB P10828 4/20 0.37
▸ KDM4E B2RXH2 4/20 0.36
▸ TERT O14746 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAPT P10636 1/20 0.34

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
SCHEMBL24159997 1.00 NPSR1 (0.39) NPSR1LMNAPKMHPGDHTT
SCHEMBL24160006 0.99 MEN1 (0.38) NPSR1LMNAPKMHPGDHTT
SCHEMBL24160651 0.93 KDM4E (0.34) KDM4ETERTALDH1A1
SCHEMBL24160714 0.93 NPSR1 (0.35) NPSR1LMNAPKMHPGDHTT
SCHEMBL24160440 0.92 AVPR1B (0.36) NPSR1LMNAPKMHPGDHTT
SCHEMBL24160391 0.91 TERT (0.34) KDM4ETERTALDH1A1
SCHEMBL24159983 0.91 KDM4E (0.38) LMNATHRBKDM4EALDH1A1
SCHEMBL24160087 0.90 MEN1 (0.35) NPSR1LMNAPKMHPGDHTT
SCHEMBL24160112 0.89 NPSR1 (0.39) NPSR1LMNAPKMHPGDHTT
SCHEMBL24160420 0.89 HDAC3 (0.34) NPSR1LMNAPKMHPGDHTT

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
EP-3932922-A1 SULFUR-CONTAINING COMPOUND BASED ON GLUTARIMIDE SKELETON AND APPLICATION THEREOF ShanghaiTech University (CN) 2022-01-05 — — EP disclosed
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