SCHEMBL6856899

SCHEMBL6856899

O=c1c2cc(Cl)ccc2n2c(N3CCCCCC3)nnc2n1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
STAT6 P42226 1/20 0.41
MAPT P10636 2/20 0.40
SRC P12931 1/20 0.40
PRKACA P17612 1/20 0.40
PRKACG P22612 1/20 0.40
PRKACB P22694 1/20 0.40
POLB P06746 1/20 0.40
CCR2 P41597 2/20 0.40
APAF1 O14727 1/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
MAOB P27338 1/20 0.38
SOS1 Q07889 1/20 0.37
KMT2A Q03164 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
PLK1 P53350 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
SCHEMBL6853905 0.93 L3MBTL1 (0.47) L3MBTL1LMNAMAPTPOLBALDH1A1
SCHEMBL7465849 0.89 L3MBTL1 (0.52) L3MBTL1LMNASMN1; SMN2MAPTPOLB
SCHEMBL6856229 0.89 L3MBTL1 (0.53) L3MBTL1LMNASMN1; SMN2MAPTPOLB
SCHEMBL6996136 0.89 MAPT (0.51) L3MBTL1LMNAMAPTALDH1A1KDM4E
SCHEMBL6850175 0.89 L3MBTL1 (0.44) L3MBTL1LMNAMAPTALDH1A1KDM4E
SCHEMBL6855322 0.89 ALDH1A1 (0.48) L3MBTL1LMNAMAPTALDH1A1KDM4E
SCHEMBL6853858 0.89 L3MBTL1 (0.55) L3MBTL1LMNAMAPTALDH1A1KDM4E
SCHEMBL6855333 0.89 L3MBTL1 (0.55) L3MBTL1LMNAMAPTALDH1A1KDM4E
SCHEMBL6856185 0.88 L3MBTL1 (0.45) L3MBTL1LMNAMAPTALDH1A1KDM4E
SCHEMBL6854118 0.88 L3MBTL1 (0.56) L3MBTL1LMNAMAPTALDH1A1KDM4E

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 4 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