SCHEMBL7340216

SCHEMBL7340216

CCOC(=O)CCc1cccnc1NC(=O)CNC(=O)c1cccc(NC(=O)Nc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPIA P62937 5/20 0.50
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 5/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MITF O75030 1/20 0.42
PAX8 Q06710 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 2/20 0.42
ATM Q13315 1/20 0.42
CSNK1D P48730 1/20 0.42

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
SCHEMBL7374343 0.88 NAMPT (0.58) PPIAKMT2A
SCHEMBL7337256 0.88 L3MBTL1 (0.48) PPIAMEN1KMT2AL3MBTL1NPC1
SCHEMBL7368777 0.83 MEN1 (0.42) PPIAMEN1KMT2AL3MBTL1NPC1
SCHEMBL7349946 0.81 L3MBTL1 (0.46) PPIAL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL7341616 0.81 L3MBTL1 (0.45) PPIAKMT2AL3MBTL1NPC1RAB9A
SCHEMBL7349032 0.81 L3MBTL1 (0.46) PPIAL3MBTL1RAB9ASMN1; SMN2MAPT
SCHEMBL7340336 0.80 KDR (0.52) PPIAL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL7343900 0.80 KMT2A (0.47) PPIAMEN1KMT2AL3MBTL1NPC1
SCHEMBL7366121 0.79 SMN1; SMN2 (0.57) MEN1KMT2AL3MBTL1NPC1RAB9A
SCHEMBL7339623 0.79 L3MBTL1 (0.46) PPIAL3MBTL1RAB9ASMN1; SMN2MAPT

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-0850221-A1 META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS G.D. SEARLE & CO. (US) 1998-07-01 EP claimed
WO-1997008145-A1 META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS G.D. SEARLE & CO. (US) 1997-03-06 WO claimed