SCHEMBL7873764

SCHEMBL7873764

N#Cc1ccc(CC(=O)NC2CCCCCC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.68
RAB9A P51151 2/20 0.68
POLB P06746 3/20 0.66
EPHX2 P34913 4/20 0.65
EPHX1 P07099 1/20 0.61
ALDH1A1 P00352 4/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
LMNA P02545 3/20 0.58
TSHR P16473 3/20 0.54
KDM4E B2RXH2 2/20 0.54
HSD17B10 Q99714 2/20 0.54
USP2 O75604 1/20 0.54
HPGD P15428 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL18648120 1.00 NPC1 (0.68) NPC1RAB9APOLBEPHX2EPHX1
SCHEMBL7105933 0.92 LMNA (0.63) NPC1RAB9APOLBEPHX2EPHX1
SCHEMBL19982101 0.87 RAB9A (0.59) NPC1RAB9APOLBEPHX2EPHX1
SCHEMBL3026453 0.87 KDM1A (0.53) NPC1RAB9APOLBEPHX2EPHX1
SCHEMBL17729947 0.81 EPHX2 (0.52) NPC1RAB9AEPHX2ALDH1A1MEN1
SCHEMBL17729946 0.81 EPHX2 (0.52) NPC1RAB9AEPHX2ALDH1A1MEN1
SCHEMBL9325905 0.81 NPC1 (1.00) NPC1RAB9APOLBEPHX2EPHX1
SCHEMBL3637147 0.80 L3MBTL1 (0.57)
SCHEMBL23686078 0.80 NPC1 (0.73) NPC1RAB9APOLBEPHX2ALDH1A1
SCHEMBL15652941 0.80 RAB9A (0.73) NPC1RAB9APOLBEPHX2EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6326500-B1 ANTIINFLAMMATORY AGENTS; ANTIALLERGENS ABBOTT LABORATORIES 2001-12-04 US disclosed
US-6215001-B1 ANTIINFLAMMATORY AGENTS, ANTIASTHMATICS, AND ANTIALLERGENS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 2001-04-10 US disclosed
US-6031109-A Phenoxy-, phenylthio-, benzoyl-alkyleneaminoalkylene-imidazole derivatives as therapeutic agents KNOLL AKTIENGESELLSCHAFT (DE) 2000-02-29 US disclosed
US-5780642-A NON-STEROIDAL ANTIINFLAMMATORY AGENT WHICH BLOCKS RELEASE OF ARACHIDONIC ACID FROM PHOSPHOLIPIDS; SIDE EFFECT REDUCTION KNOLL AKTIENGESELLSCHAFT (DE) 1998-07-14 US disclosed
EP-0705251-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS Knoll AG (DE) 1996-04-10 EP disclosed
WO-1995000493-A1 IMIDAZOLE DERIVATIVES AS THERAPEUTIC AGENTS KNOLL AG (DE) 1995-01-05 WO disclosed