SCHEMBL9940282

SCHEMBL9940282

O=C(Nc1ccccc1)C1CCOCC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.69
MAPT P10636 3/20 0.67
GAA P10253 3/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
GFER P55789 1/20 0.67
MAPK8 P45983 2/20 0.60
MAPK10 P53779 2/20 0.60
MAPK14 Q16539 2/20 0.60
GLA P06280 1/20 0.59
ME3 Q16798 1/20 0.57
HDAC3 O15379 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC2 Q92769 1/20 0.57
KDM4E B2RXH2 1/20 0.57
NPC1 O15118 1/20 0.57
LMNA P02545 1/20 0.57
CASP3 P42574 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL501924 0.87 GAA (0.85) HPGDMAPTGAAMEN1KMT2A
SCHEMBL10055001 0.87 GAA (0.85) HPGDMAPTGAAMEN1KMT2A
SCHEMBL29675219 0.87 GAA (0.85) HPGDMAPTGAAMEN1KMT2A
Hydrochloric Acid SCHEMBL1804763 0.85 GAA (0.82) HPGDMAPTGAAMEN1KMT2A
SCHEMBL31401961 0.84 KMT2A (0.56) HPGDMAPTGAAMEN1KMT2A
SCHEMBL7869933 0.84 KMT2A (0.58) HPGDMAPTGAAMEN1KMT2A
SCHEMBL2184247 0.83 HPGD (0.89) HPGDMAPTGAAMEN1KMT2A
SCHEMBL4668488 0.83 HPGD (0.96) HPGDMAPTGAAMEN1KMT2A
SCHEMBL13460461 0.83 ALDH1A1 (0.55) HPGDMAPTGAAMEN1KMT2A
SCHEMBL5198248 0.83 ALDH1A1 (0.51) HPGDMAPTGAAMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024227104-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BRAF VIA UBIQUITIN PROTEOSOME PATHWAY NURIX THERAPEUTICS, INC. (US) 2024-10-31 WO disclosed
CN-114213255-A Synthetic method of six-membered ring benzylamine compound 上海泰坦科技股份有限公司 2022-03-22 CN disclosed
EP-2651930-A1 BIARYLAMIDE INHIBITORS OF LEUKOTRIENE PRODUCTION Boehringer Ingelheim International GmbH (DE) 2013-10-23 EP disclosed
WO-2012082817-A1 BIARYLAMIDE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-21 WO disclosed