SCHEMBL6996136

SCHEMBL6996136

Cc1ccc(Cn2c(=O)c3cc(Cl)ccc3n3c(N4CCCCCC4)nnc23)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 4/20 0.44
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44
TP53 P04637 4/20 0.44
HPGD P15428 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.41
HTT P42858 1/20 0.41
PLK1 P53350 1/20 0.39

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
SCHEMBL6853905 0.94 L3MBTL1 (0.47) MAPTL3MBTL1ALDH1A1MAPK1TP53
SCHEMBL7455414 0.92 MAPT (0.48) MAPTL3MBTL1ALDH1A1TSHRMAPK1
SCHEMBL6855322 0.90 ALDH1A1 (0.48) MAPTL3MBTL1ALDH1A1TP53NPSR1
SCHEMBL6850175 0.90 L3MBTL1 (0.44) MAPTL3MBTL1ALDH1A1TSHRTP53
SCHEMBL6855333 0.90 L3MBTL1 (0.55) MAPTL3MBTL1ALDH1A1TSHRTP53
SCHEMBL6853858 0.90 L3MBTL1 (0.55) MAPTL3MBTL1ALDH1A1TSHRTP53
SCHEMBL6858383 0.89 MAPT (0.45) MAPTL3MBTL1TP53NPSR1LMNA
SCHEMBL6856899 0.89 L3MBTL1 (0.43) MAPTL3MBTL1ALDH1A1TP53LMNA
SCHEMBL6856185 0.89 L3MBTL1 (0.45) MAPTL3MBTL1ALDH1A1TP53LMNA
SCHEMBL6854118 0.89 L3MBTL1 (0.56) MAPTL3MBTL1ALDH1A1TSHRTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1177195-B1 1-AMINO TRIAZOLO 4,3-a! QUINAZOLINE-5-ONES AND OR -5-THIONES INHIBITING PHOSPHODIESTERASE IV WARNER LAMBERT CO (US) 2003-03-19 EP claimed
US-6828315-B1 Anti- inflammatories, anti-allergics, bronchodilatators, anti-asthmatics, or TNF alpha inhibitors WARNER-LAMBERT LLC 2004-12-07 US disclosed
EP-1177195-B1 1-AMINO TRIAZOLO 4,3-a! QUINAZOLINE-5-ONES AND OR -5-THIONES INHIBITING PHOSPHODIESTERASE IV WARNER LAMBERT CO (US) 2003-03-19 EP disclosed
EP-1177195-A1 1-AMINO TRIAZOLO 4,3-a! QUINAZOLINE-5-ONES AND OR -5-THIONES INHIBITING PHOSPHODIESTERASE IV WARNER-LAMBERT COMPANY (US) 2002-02-06 EP disclosed
WO-2000066584-A1 1-AMINO TRIAZOLO¢4,3-a! QUINAZOLINE-5-ONES AND OR -5-THIONES INHIBITING PHOSPHODIESTERASE IV WARNER-LAMBERT COMPANY (US) 2000-11-09 WO disclosed