SCHEMBL8975781

SCHEMBL8975781

CCOc1ccc(N)c(OC)c1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.49
GAA P10253 2/20 0.49
ALDH1A1 P00352 3/20 0.48
HSD17B10 Q99714 2/20 0.48
MAPK1 P28482 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
POLB P06746 1/20 0.48
HPGD P15428 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PDE4A P27815 3/20 0.44
PDE4B Q07343 3/20 0.44
PDE4C Q08493 3/20 0.44
PDE4D Q08499 3/20 0.44
NPC1 O15118 2/20 0.42
USP2 O75604 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CREBBP Q92793 1/20 0.41

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
SCHEMBL9793008 0.88 MAPT (0.52) KDM4EMAPTGAAALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL9793078 0.86 MAPT (0.50) KDM4EMAPTGAAALDH1A1HSD17B10
SCHEMBL29452826 0.81 IDO1 (0.48) KDM4EMAPTGAAALDH1A1HSD17B10
SCHEMBL455551 0.81 IDO1 (0.48) KDM4EMAPTGAAALDH1A1HSD17B10
SCHEMBL27494768 0.79 KDM4E (0.60) KDM4EMAPTGAAALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL10535611 0.79 EP300 (0.50) KDM4EMAPTGAAALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL9793151 0.79 EP300 (0.50) KDM4EMAPTGAAALDH1A1HSD17B10
SCHEMBL28060146 0.79 MAPT (0.55) KDM4EMAPTGAAALDH1A1HSD17B10
SCHEMBL6675123 0.78 ALDH1A1 (0.53) KDM4EMAPTGAAALDH1A1HSD17B10
SCHEMBL3426858 0.77 ALDH1A1 (0.62) KDM4EMAPTGAAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705863-A1 Two stage melt polymerization process for making polybenzimidazoles HOECHST CELANESE CORPORATION (US) 1996-04-10 EP disclosed
US-4895928-A AROMATIC POLYAMIDES AMOCO CORPORATION (US) 1990-01-23 US disclosed
US-4717764-A Two stage melt polymerization process for making polymers containing aromatic amide groups CELANESE CORPORATION (US) 1988-01-05 US disclosed