SCHEMBL30900618

SCHEMBL30900618

Brc1cc(N2CCOCC2)ccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
LGMN Q99538 1/20 0.45
CDK1 P06493 1/20 0.45
CDK2 P24941 1/20 0.45
PIK3CA P42336 3/20 0.43
PRKDC P78527 3/20 0.42
PIK3CD O00329 2/20 0.42
PIK3CB P42338 2/20 0.42
ALDH1A1 P00352 3/20 0.42
ALOX15 P16050 3/20 0.42
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 1/20 0.42
MAPT P10636 6/20 0.42
HTT P42858 4/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LRRK2 Q5S007 1/20 0.42

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
SCHEMBL3304237 1.00 LMNA (0.46) LMNALGMNCDK1CDK2PIK3CA
SCHEMBL25247515 0.83 HRH4 (0.47)
SCHEMBL1634508 0.83 CHKA (0.52) LMNAALDH1A1ALOX15MAPTHTT
SCHEMBL30900615 0.83 CHKA (0.52) LMNAALDH1A1ALOX15MAPTHTT
SCHEMBL31341814 0.81 HRH4 (0.54) LMNAALDH1A1ALOX15KDM4EHSD17B10
SCHEMBL5314278 0.81 HRH4 (0.54) LMNAALDH1A1ALOX15KDM4EHSD17B10
SCHEMBL27936855 0.80 LRRK2 (0.59) LMNALGMNCDK1CDK2PIK3CA
SCHEMBL26604075 0.79 KDM4E (0.48) LMNALGMNALDH1A1ALOX15KDM4E
SCHEMBL114416 0.79 LGMN (0.53) LMNALGMNCDK1CDK2PIK3CA
SCHEMBL21807926 0.79 LMNA (0.46) LMNALGMNCDK1CDK2PIK3CA

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
CN-112204009-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2024-05-07 CN disclosed