SCHEMBL6465748

SCHEMBL6465748

NC(=O)CC(CC(O)(CCc1ccccc1)c1nc2cc(Cl)ccc2o1)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
KMT2A Q03164 1/20 0.40
PTGES O14684 9/20 0.38
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
PTGS2 P35354 4/20 0.36
XDH P47989 1/20 0.36
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX12 P18054 1/20 0.35
KDM1A O60341 1/20 0.35
CETP P11597 1/20 0.35

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
SCHEMBL6466340 0.89 LMNA (0.39) LMNAKMT2ANPC1RAB9AXDH
SCHEMBL6463655 0.89 LMNA (0.39) LMNAKMT2ANPC1RAB9AXDH
SCHEMBL6462679 0.77 FAAH (0.37) KMT2ANPC1RAB9ATP53SMN1; SMN2
SCHEMBL7045923 0.76 KMT2A (0.46) LMNAKMT2APTGESRAB9APTGS2
SCHEMBL6462292 0.73 DAGLA (0.39) LMNAKMT2ANPC1RAB9AXDH
SCHEMBL6464160 0.71 LMNA (0.39) LMNAKMT2ANPC1RAB9ATP53
SCHEMBL6467443 0.69 FAAH (0.36) LMNANPC1RAB9APTGS2XDH
SCHEMBL6463984 0.68 DAGLA (0.40) NPC1RAB9ASMN1; SMN2CETP
SCHEMBL6466282 0.67 LMNA (0.39) LMNAKMT2ANPC1RAB9ATP53
SCHEMBL7044868 0.67 LMNA (0.37) LMNAKMT2ANPC1RAB9AXDH

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
EP-1516877-A1 Amine derivatives as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-23 EP disclosed