SCHEMBL14920792

SCHEMBL14920792

CCCCCC(C)C(=O)NCc1ccc(Cl)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
MAPK1 P28482 1/20 0.50
NLRP1 Q9C000 1/20 0.50
P2RX7 Q99572 10/20 0.47
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL14920505 0.82 TSHR (0.56) LMNAMAPK1NLRP1P2RX7SMN1; SMN2
SCHEMBL18887747 0.82 LMNA (0.57) LMNAMAPK1NLRP1P2RX7SMN1; SMN2
SCHEMBL1143411 0.78 LMNA (0.53) LMNAMAPK1NLRP1P2RX7SMN1; SMN2
SCHEMBL6649593 0.77 HTT (0.69) LMNAMAPK1NLRP1P2RX7SMN1; SMN2
SCHEMBL2748481 0.74 LMNA (0.52) LMNAMAPK1NLRP1P2RX7SMN1; SMN2
SCHEMBL10900021 0.74 ALDH1A1 (0.59) LMNAMAPK1NLRP1P2RX7ALDH1A1
SCHEMBL28706018 0.73 KCNH2 (0.52) LMNAMAPK1NLRP1P2RX7ALDH1A1
SCHEMBL17914676 0.73 ALDH1A1 (0.62) LMNAMAPK1NLRP1P2RX7ALDH1A1
SCHEMBL9114275 0.73 MAPT (0.51) LMNAMAPK1L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9112200 0.73 MAPT (0.51) LMNAMAPK1L3MBTL1SMN1; SMN2ALDH1A1

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
EP-2773644-A1 AZETIDINE COMPOUNDS, COMPOSITIONS AND THEIR USE AS INHIBITORS OF SOLUBLE EPOXIDE HYDROLASE F.HOFFMANN-LA ROCHE AG (CH) 2014-09-10 EP disclosed
WO-2013064467-A1 AZETIDINE COMPOUNDS, COMPOSITIONS AND THEIR USE AS INHIBITORS OF SOLUBLE EPOXIDE HYDROLASE F. HOFFMANN-LA ROCHE AG (CH) 2013-05-10 WO disclosed