SCHEMBL30897342

SCHEMBL30897342

C=Cc1nc2ccccc2n1CCOC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.69
KDM4E B2RXH2 5/20 0.69
SMN1; SMN2 Q16637 5/20 0.69
NPC1 O15118 5/20 0.69
ALDH1A1 P00352 4/20 0.69
GLA P06280 2/20 0.69
GAA P10253 2/20 0.69
PKM P14618 1/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
HPGD P15428 2/20 0.59
TSHR P16473 3/20 0.52
CASR P41180 1/20 0.52
TP53 P04637 2/20 0.51
KMT2A Q03164 1/20 0.51
RECQL P46063 1/20 0.51
HSD17B10 Q99714 1/20 0.51
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48

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
SCHEMBL30897374 0.92 KDM4E (0.72) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL19863783 0.85 RAB9A (0.69) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL30897366 0.85 SMN1; SMN2 (0.51) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
Hydrochloric Acid SCHEMBL4727271 0.83 RAB9A (0.66) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL5576433 0.80 KDM4E (0.50) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL18584288 0.80 HPGD (0.64) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL5009001 0.78 HPGD (0.70) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL18046824 0.77 HPGD (0.64) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL3144343 0.77 HPGD (0.64) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1
SCHEMBL15595665 0.77 POLB (0.69) RAB9AKDM4ESMN1; SMN2NPC1ALDH1A1

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-4605398-A1 BICYCLIC FERROPORTIN INHIBITORS Vifor (International) AG (CH) 2025-08-27 EP disclosed
WO-2024083980-A1 BICYCLIC FERROPORTIN INHIBITORS VIFOR (INTERNATIONAL) AG (CH) 2024-04-25 WO disclosed