SCHEMBL25911404

SCHEMBL25911404

CSc1cnc(Cl)c(N)n1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
IDO1 P14902 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
NUDT1 P36639 1/20 0.30

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
SCHEMBL1903645 0.75 KDM4E (0.44) KDM4EALDH1A1LMNAIDO1GLA
SCHEMBL14038382 0.73 KDM4E (0.33) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL10139091 0.72 KDM4E (0.32) KDM4EALDH1A1LMNAGLAGAA
SCHEMBL12090830 0.71
SCHEMBL2930119 0.71 KDM4E (0.44) KDM4EALDH1A1LMNAIDO1GLA
SCHEMBL25911070 0.71 KDM4E (0.41) KDM4EALDH1A1LMNAIDO1GLA
SCHEMBL7350230 0.70
SCHEMBL29625025 0.70
SCHEMBL2414672 0.70
SCHEMBL275143 0.69

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-2023147418-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2023-08-03 WO disclosed