SCHEMBL21981235

SCHEMBL21981235

COc1ccc2c(CC(=O)N[C@@H](CCCCN)C(=O)O)cc(=O)oc2c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ KDM4E B2RXH2 4/20 0.61
▸ LCK P06239 1/20 0.61
▸ ALDH1A1 P00352 3/20 0.60
▸ HPGD P15428 3/20 0.60
▸ CA12 O43570 6/20 0.56
▸ CA1 P00915 6/20 0.56
▸ CA2 P00918 6/20 0.56
▸ CA9 Q16790 6/20 0.56
▸ CYP2D6 P10635 3/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ CA3 P07451 1/20 0.47
▸ CA4 P22748 1/20 0.47
▸ CA5A P35218 1/20 0.47
▸ CA7 P43166 1/20 0.47
▸ CA14 Q9ULX7 1/20 0.47
▸ CA5B Q9Y2D0 1/20 0.47
▸ LMNA P02545 1/20 0.47

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
SCHEMBL21981236 1.00 MEN1 (0.61) MEN1KMT2AKDM4ELCKALDH1A1
SCHEMBL3256313 0.86 MEN1 (0.57) MEN1KMT2AKDM4ELCKALDH1A1
SCHEMBL18575811 0.86 KDM4E (0.72) MEN1KMT2AKDM4ELCKALDH1A1
SCHEMBL30050571 0.82 KDM4E (0.70) MEN1KMT2AKDM4ELCKALDH1A1
SCHEMBL26793195 0.81 KDM4E (0.59) MEN1KMT2AKDM4ELCKALDH1A1
SCHEMBL23354031 0.79 KDM4E (0.52) MEN1KMT2AKDM4ELCKALDH1A1
SCHEMBL246218 0.77 KDM4E (1.00) KDM4ELCKALDH1A1HPGDCA12
SCHEMBL29397959 0.77 KDM4E (1.00) KDM4ELCKALDH1A1HPGDCA12
SCHEMBL30778957 0.77 SLC17A5 (0.56) MEN1KMT2AKDM4ELCKALDH1A1
SCHEMBL28382781 0.77 KDM4E (0.45) MEN1KMT2AKDM4ELCKALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3656861-B1 ACTIVE MMP9-BINDING PEPTIDE DAIICHI SANKYO CO LTD (JP) 2025-07-23 — — EP disclosed
US-12043658-B2 Conjugate comprising an active MMP-9-binding peptide DAIICHI SANKYO COMPANY, LIMITED (JP) 2024-07-23 — — US disclosed
US-11926655-B2 Active MMP9-binding peptide DAIICHI SANKYO COMPANY, LIMITED (JP) 2024-03-12 — — US disclosed
US-20230203132-A1 ACTIVE MMP9-BINDING PEPTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2023-06-29 — — US disclosed
US-20200231654-A1 ACTIVE MMP9-BINDING PEPTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-07-23 — — US disclosed
EP-3656861-A1 ACTIVE MMP9-BINDING PEPTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-05-27 — — EP disclosed
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