SCHEMBL30749250

SCHEMBL30749250

CCOC(=O)c1[nH]ccc1NCc1ccccc1C1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.46
▸ JAK1 P23458 2/20 0.46
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ USP30 Q70CQ3 2/20 0.39
▸ HPGDS O60760 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ GPR119 Q8TDV5 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ ALOX15 P16050 1/20 0.37
▸ KDM1A O60341 1/20 0.37
▸ ACKR3 P25106 1/20 0.37
▸ TRPV3 Q8NET8 1/20 0.37

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
SCHEMBL27224082 1.00 JAK2 (0.46) JAK2JAK1MEN1KMT2AKDM4E
SCHEMBL30749339 0.91 JAK2 (0.43) JAK2JAK1MEN1KMT2AKDM4E
SCHEMBL27223438 0.91 JAK2 (0.43) JAK2JAK1MEN1KMT2AKDM4E
SCHEMBL27224143 0.89 TSHR (0.38) JAK2JAK1MEN1KMT2AKDM4E
SCHEMBL27223619 0.85 IDO1 (0.37) JAK2JAK1MEN1KMT2AKDM4E
SCHEMBL30749256 0.85 IDO1 (0.37) JAK2JAK1MEN1KMT2AKDM4E
SCHEMBL27223567 0.85 ATM (0.38) JAK2JAK1MEN1KMT2AMAPT
SCHEMBL27223426 0.84 KMT2A (0.47) MEN1KMT2AKDM4EALDH1A1GLA
SCHEMBL30749239 0.84 KMT2A (0.47) MEN1KMT2AKDM4EALDH1A1GLA
SCHEMBL30749254 0.84 KMT2A (0.46) MEN1KMT2AKDM4EALDH1A1GLA

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-4573096-A1 INHIBITORS OF MYELOPEROXIDASE Astrazeneca AB (SE) 2025-06-25 — — EP disclosed
WO-2024038131-A1 INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-02-22 — — WO disclosed
Send feedback