SCHEMBL31558258

SCHEMBL31558258

Nc1c(C(=O)O)cc(F)nc1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.39
KEAP1 Q14145 2/20 0.39
GLA P06280 1/20 0.39
NFE2L2 Q16236 1/20 0.38
IDO1 P14902 1/20 0.35
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 2/20 0.34
GABRB2 P47870 2/20 0.34
GABRA4 P48169 2/20 0.34
GABRE P78334 2/20 0.34
GABRA6 Q16445 2/20 0.34
GABRG1 Q8N1C3 2/20 0.34
GABRG3 Q99928 2/20 0.34

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
SCHEMBL31558242 0.85 DGAT1 (0.42) KDM4EGLAKMT2ARXFP1MEN1
SCHEMBL535621 0.81 KDM4E (0.41) KDM4EGLAIDO1GABRPGABRD
SCHEMBL25208528 0.80 KDM4E (0.44) KDM4EGLATSHRMAPTHSD17B10
SCHEMBL25361675 0.78 KDM4E (0.47) KDM4EGLAGABRPGABRDGABRA1
SCHEMBL535620 0.78 KDM4E (0.39) KDM4EKEAP1GLANFE2L2IDO1
SCHEMBL31330687 0.78 KDM4E (0.39) KDM4EKEAP1GLANFE2L2IDO1
SCHEMBL30791054 0.71 GAA (0.40) CA1CA2CA3CA9MAPT
SCHEMBL16702812 0.71 GAA (0.40) CA1CA2CA3CA9MAPT
SCHEMBL30067156 0.70 KEAP1 (0.46) KDM4EKEAP1GLANFE2L2IDO1
SCHEMBL951409 0.69 KEAP1 (0.50) KDM4EKEAP1GLAKMT2ACA12

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-2025101598-A1 BI-CYCLIC PYRIMIDINE COMPOUNDS, METHODS AND USES THEREOF ZENO MANAGEMENT, INC. (US) 2025-05-15 WO disclosed