SCHEMBL1446580

SCHEMBL1446580

O=C(Nc1cccc(Cl)c1)C1CCNCC1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.58
MALT1 Q9UDY8 1/20 0.57
KMT2A Q03164 4/20 0.56
ALPL P05186 1/20 0.56
ALPI P09923 1/20 0.56
ALPG P10696 1/20 0.56
ALDH1A1 P00352 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
MEN1 O00255 3/20 0.56
LMNA P02545 2/20 0.56
MAPT P10636 2/20 0.56
HTT P42858 2/20 0.56
NPSR1 Q6W5P4 1/20 0.54
MAOB P27338 1/20 0.54
UBE2M P61081 1/20 0.53
DCUN1D1 Q96GG9 1/20 0.53

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
SCHEMBL23109077 0.91 MGLL (0.64) MGLLMALT1KMT2AALPLALPI
SCHEMBL2246607 0.86 MEN1 (0.69) KMT2AALDH1A1SMN1; SMN2MEN1LMNA
SCHEMBL2449231 0.85 F10 (0.56) MGLLKMT2AALPLALPIALPG
SCHEMBL27852313 0.83 MEN1 (0.49) KMT2AALDH1A1SMN1; SMN2MEN1LMNA
SCHEMBL1720856 0.83 MGLL (0.56) MGLLALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL18395563 0.83 KMT2A (0.58) MGLLKMT2ASMN1; SMN2MEN1LMNA
SCHEMBL4141969 0.82 HPGD (0.69) KMT2ASMN1; SMN2MEN1LMNAMAPT
SCHEMBL28431130 0.82 GRK2 (0.58) ALDH1A1SMN1; SMN2LMNAHTTNPSR1
SCHEMBL27347877 0.82 F10 (0.63) MGLLKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL259383 0.82 NPSR1 (0.78) KMT2AALDH1A1SMN1; SMN2MEN1LMNA

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
CN-112341396-B Novel monoacylglycerol esterase inhibitor and preparation method and application thereof 四川大学华西医院 2022-07-26 CN disclosed
WO-2021042911-A1 MAGL INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 鲁南制药集团股份有限公司 2021-03-11 WO disclosed
CN-112341396-A Novel monoacylglycerol esterase inhibitor and preparation method and application thereof 四川大学华西医院 2021-02-09 CN disclosed
EP-2297153-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE Lexicon Pharmaceuticals, Inc. (US) 2011-03-23 EP disclosed