SCHEMBL6854129

SCHEMBL6854129

COc1ccc(Cn2c(=O)c3cc(Br)ccc3n3c(N4CCCCC4)nnc23)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.40
HPGD P15428 1/20 0.39
TP53 P04637 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PDE7A Q13946 5/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PDE7B Q9NP56 2/20 0.37
PDE8A O60658 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
HSP90AA1 P07900 1/20 0.37

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
SCHEMBL6855972 1.00 MAPT (0.41) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL6854057 0.99 MAPT (0.42) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL7529993 0.93 PIK3R1 (0.40) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL7146999 0.93 PIK3R1 (0.40) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL6853783 0.90 ALDH1A1 (0.44) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL7466523 0.89 MAPT (0.40) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL7466520 0.89 MAPT (0.40) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL6850034 0.89 MEN1 (0.42) MAPTALDH1A1LMNAHPGDTP53
SCHEMBL6850147 0.89 ALDH1A1 (0.45) MAPTALDH1A1LMNATSHRHPGD
SCHEMBL7469651 0.89 MAPT (0.40) MAPTALDH1A1LMNATSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6828315-B1 Anti- inflammatories, anti-allergics, bronchodilatators, anti-asthmatics, or TNF alpha inhibitors WARNER-LAMBERT LLC 2004-12-07 US claimed
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
US-20020119967-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of IL-12-production WARNER-LAMBERT COMPANY 2002-08-29 US disclosed
WO-2002022112-A9 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING A DISEASE ASSOCIATED WITH AN EXCESS OF IL-12 PRODUCTION WARNER LAMBERT CO (US) 2002-06-06 WO disclosed
EP-1199074-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of il-12 production WARNER-LAMBERT COMPANY (US) 2002-04-24 EP disclosed
EP-1188438-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of Il-12 production WARNER-LAMBERT COMPANY (US) 2002-03-20 EP disclosed