SCHEMBL24401981

SCHEMBL24401981

CCN1C[C@H]2C[C@@H]1CN2CCO

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AGL P35573 3/20 0.39
GAA P10253 8/20 0.38
MGAM O43451 3/20 0.38
SI P14410 3/20 0.38
GBA1 P04062 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LCT P09848 1/20 0.38
OPRL1 P41146 1/20 0.34
GBA2 Q9HCG7 8/20 0.31
UGCG Q16739 3/20 0.31
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 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
SCHEMBL12337293 1.00 AGL (0.39) AGLGAAMGAMSIGBA1
SCHEMBL5441422 0.89 AGL (0.46) AGLGAAMGAMSIGBA1
SCHEMBL18874061 0.83 GAA (0.38) GAA
SCHEMBL13662010 0.83 GAA (0.38) GAA
SCHEMBL18820448 0.83 AGL (0.39) AGLGAAMGAMSIGBA1
SCHEMBL24402950 0.83 AGL (0.39) AGLGAAMGAMSIGBA1
SCHEMBL24402941 0.83 AGL (0.39) AGLGAAMGAMSIGBA1
SCHEMBL23732000 0.78 AGL (0.40) AGLGAAMGAMSIGBA1
SCHEMBL18513254 0.77 HSD11B1 (0.38) GAA
SCHEMBL20757950 0.77 HSD11B1 (0.38) GAA

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-2022090481-A1 SUBSTITUTED 1H-PYRAZOLO[4,3-C]PYRIDINES AND DERIVATIVES AS EGFR INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-05-05 WO disclosed