SCHEMBL5278583

SCHEMBL5278583

CCCNC(=O)N1CCN(Cc2ccc(OC)c(Cl)c2)C(CC(N)=O)C1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
CCR3 P51677 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
EGFR P00533 1/20 0.38
FAAH O00519 1/20 0.38
NPC1 O15118 1/20 0.37
GFER P55789 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 2/20 0.37
ENPP2 Q13822 1/20 0.36

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
SCHEMBL5192869 0.87 OPRK1 (0.46) LMNACCR3L3MBTL1MAPK1EGFR
SCHEMBL5191068 0.86 LMNA (0.44) LMNACCR3L3MBTL1MAPK1POLB
SCHEMBL5193908 0.86 LMNA (0.42) LMNAMAPK1
SCHEMBL5190760 0.84 ALDH1A1 (0.49) MAPK1POLBGFERALDH1A1
SCHEMBL5193992 0.81 SMN1; SMN2 (0.48) LMNAGFERKDM4EALDH1A1
SCHEMBL5194076 0.79 ALDH1A1 (0.44) LMNAKDM4EALDH1A1
SCHEMBL5193163 0.79 SMN1; SMN2 (0.44) LMNACCR3L3MBTL1MAPK1POLB
SCHEMBL5190656 0.76 KMT2A (0.53) L3MBTL1MAPK1POLBNPC1GFER
SCHEMBL5207365 0.76 LMNA (0.41) LMNACCR3L3MBTL1MAPK1POLB
SCHEMBL5190692 0.75 ALDH1A1 (0.48) LMNACCR3L3MBTL1MAPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0968206-B8 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX INC (US) 2007-01-24 EP claimed
EP-0968206-A1 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX LABORATORIES, INC. (US) 2000-01-05 EP claimed
WO-1998037079-A1 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX LABORATORIES, INC. (US) 1998-08-27 WO claimed