SCHEMBL24920810

SCHEMBL24920810

COc1nc(-c2nnco2)ncc1F

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
NOTUM Q6P988 8/20 0.38
HPGD P15428 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
GUCY1B2 O75343 1/20 0.34
GUCY1A2 P33402 1/20 0.34
GUCY1A1 Q02108 1/20 0.34
GUCY1B1 Q02153 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
EDNRA P25101 1/20 0.33
KMT2A Q03164 1/20 0.33
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 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
SCHEMBL24920782 0.76 PIM1 (0.36) NOTUMGUCY1B2GUCY1A2GUCY1A1GUCY1B1
SCHEMBL24920791 0.74 GUCY1B2 (0.35) HPGDALDH1A1GUCY1B2GUCY1A2GUCY1A1
SCHEMBL24922007 0.74 NOTUM (0.50) MAPTNOTUMHPGDALDH1A1MAPK1
SCHEMBL27083154 0.74 NOTUM (0.43) MAPTNOTUMHPGDALDH1A1MAPK1
SCHEMBL24922536 0.73 MAPT (0.49) MAPTNOTUMHPGDALDH1A1MAPK1
SCHEMBL24920806 0.73 GUCY1B2 (0.36) MAPTHPGDALDH1A1GUCY1B2GUCY1A2
SCHEMBL24920864 0.73 MAPT (0.39) MAPTNOTUMHPGDALDH1A1MAPK1
SCHEMBL24920793 0.72 GUCY1B2 (0.40) GUCY1B2GUCY1A2GUCY1A1GUCY1B1KMT2A
SCHEMBL24921992 0.71 MAPT (0.42) MAPTNOTUMHPGDALDH1A1MAPK1
SCHEMBL24920787 0.69 ALDH1A1 (0.43) MAPTNOTUMHPGDALDH1A1MAPK1

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-2023006097-A1 BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUND AND USE THEREOF AS ANDROGEN RECEPTOR DEGRADER 海创药业股份有限公司 2023-02-02 WO disclosed