SCHEMBL25757086

SCHEMBL25757086

CCn1ccc(NC)c(C(=N)I)c1=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.34
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL14467741 0.68 IDH1 (0.44) KDM4EALDH1A1MAPK1
SCHEMBL12417619 0.66 BRD4 (0.38) KDM4EALDH1A1
SCHEMBL25757085 0.65 PARP1 (0.32)
SCHEMBL1399812 0.62 CA12 (0.50) KDM4EALDH1A1
SCHEMBL14625069 0.62 RAB9A (0.34) KDM4EALDH1A1MAPK1
Hydrochloric Acid SCHEMBL17594820 0.61 CA12 (0.39) KDM4EALDH1A1MAPK1
SCHEMBL27305850 0.60 LIPG (0.38) CRBNKDM4EALDH1A1
SCHEMBL17029567 0.60 HDAC8 (0.32) KDM4EALDH1A1MAPK1
SCHEMBL23839890 0.59 GABRA1 (0.45) KDM4EALDH1A1MAPK1
SCHEMBL24019687 0.58 IDH1 (0.44) KDM4EALDH1A1MAPK1

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
WO-2023109954-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed