SCHEMBL7763507

SCHEMBL7763507

NCCCC[C@H](NC(=O)C1OC1C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1)C(=O)Nc1cccc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NTMT1 Q9BV86 1/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CALCRL Q16602 1/20 0.47
CAPN1 P07384 4/20 0.45
PLG P00747 2/20 0.44
SSTR3 P32745 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42
HSD17B10 Q99714 1/20 0.41
KLKB1 P03952 2/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
USP30 Q70CQ3 2/20 0.41
PLAU P00749 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
Hydrochloric Acid SCHEMBL7758991 0.99 NTMT1 (0.51) NTMT1MEN1KMT2ACALCRLCAPN1
SCHEMBL7765698 0.92 NTMT1 (0.51) NTMT1MEN1KMT2AKDM4EHDAC1
SCHEMBL7762774 0.92 NTMT1 (0.52) NTMT1MEN1KMT2ACAPN1KDM4E
Hydrochloric Acid SCHEMBL7764055 0.91 NTMT1 (0.50) NTMT1MEN1KMT2AKDM4EHDAC1
Hydrochloric Acid SCHEMBL7764097 0.91 NTMT1 (0.51) NTMT1MEN1KMT2ACAPN1KDM4E
SCHEMBL7765678 0.90 NTMT1 (0.49) NTMT1MEN1KMT2ACALCRL
SCHEMBL7761871 0.90 NTMT1 (0.49) NTMT1MEN1KMT2ACALCRL
SCHEMBL7765746 0.89 NTMT1 (0.48) NTMT1MEN1KMT2APLGSSTR3
Hydrochloric Acid SCHEMBL7761875 0.89 NTMT1 (0.48) NTMT1MEN1KMT2ACALCRL
Hydrochloric Acid SCHEMBL7761862 0.89 NTMT1 (0.48) NTMT1MEN1KMT2ACALCRL

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
EP-0808839-B1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO LTD (JP) 2001-05-23 EP disclosed
EP-0808839-A1 EPOXYSUCCINAMIDE DERIVATIVES OR SALTS THEREOF, AND DRUGS CONTAINING THE SAME TAIHO PHARMACEUTICAL CO., LTD. (JP) 1997-11-26 EP disclosed