SCHEMBL9733457

SCHEMBL9733457

COC1NC(=O)N(c2ccc(Cl)cc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.43
MGLL Q99685 1/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
SMO Q99835 2/20 0.38
LMNA P02545 2/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL13585606 0.83 GAA (0.50) MGLLMEN1KMT2AHSD17B10ALDH1A1
SCHEMBL13879504 0.77 ELANE (0.47) ELANEMGLLMEN1KMT2AHSD17B10
SCHEMBL13879522 0.73 LMNA (0.62) ELANEMGLLMEN1KMT2AHSD17B10
SCHEMBL13879428 0.71 LMNA (0.49) ELANEMGLLMEN1KMT2AHSD17B10
SCHEMBL13879419 0.70 AR (0.62) ELANEMGLLMEN1KMT2AALDH1A1
SCHEMBL11866914 0.69 LMNA (0.47) ELANEMGLLMEN1KMT2AHSD17B10
SCHEMBL13879400 0.69 GRM2 (0.44) ELANEMGLLALDH1A1SMOLMNA
SCHEMBL11612591 0.68 KMT2A (0.48) ELANEMGLLMEN1KMT2AALDH1A1
SCHEMBL4437165 0.67 LMNA (0.54) MGLLMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4439021 0.67 LMNA (0.54) MGLLMEN1KMT2AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5098888-A Cholinergic agents and antispasmodic agents ADIR ET COMPAGNIE (FR) 1992-03-24 US disclosed
EP-0105102-A1 2-Aza-bicyclo(2,2,2)-octane-3-carboxylic-acid derivatives, process for their preparation, pharmaceutical preparations containing them and their application, and 2-aza-bicyclo(2,2,2)-octane-3-carboxylic acid as an intermediate and its preparation HOECHST AKTIENGESELLSCHAFT (DE) 1984-04-11 EP disclosed