SCHEMBL31479337

SCHEMBL31479337

Cc1cn2c(Br)ccc2cn1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
NPC1 O15118 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
CHEK1 O14757 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
LIMK1 P53667 1/20 0.32
MAPK14 Q16539 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL19631265 0.79 KDM4E (0.33) KDM4ENPC1MAPK1RAB9ACHEK1
SCHEMBL25516750 0.70 CYP2A6 (0.32) KDM4ECHEK1ALDH1A1MAPTLIMK1
Hydrochloric Acid SCHEMBL6229671 0.69 KDM4E (0.44) KDM4EMAPK1ALDH1A1MAPTTDP1
SCHEMBL20116291 0.68 CYP1A2 (0.38) KDM4ENPC1MAPK1RAB9ACHEK1
SCHEMBL26690104 0.67 SMN1; SMN2 (0.37) KDM4ENPC1MAPK1RAB9AALDH1A1
SCHEMBL23293949 0.65 L3MBTL1 (0.43) KDM4EGAA
SCHEMBL31748007 0.65 LMNA (0.33)
SCHEMBL31748001 0.65 HTT (0.31)
SCHEMBL25172368 0.64 UHRF1 (0.33) KDM4ENPC1RAB9AALDH1A1MAPT
SCHEMBL31569340 0.63 SCN5A (0.45)

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-2025067111-A1 MENIN-MLL INTERACTION INHIBITOR AND PREPARATION METHOD THEREFOR, AND APPLICATION 苏州必扬医药科技有限公司 2025-04-03 WO disclosed