SCHEMBL11063149

SCHEMBL11063149

COc1cc(O)cc(C)c1CNc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.53
MAPT P10636 4/20 0.47
ALDH1A1 P00352 4/20 0.43
GAA P10253 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
THRB P10828 2/20 0.43
BLM P54132 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
CASP1 P29466 1/20 0.42
HTT P42858 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RAB9A P51151 1/20 0.41
MAOB P27338 2/20 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
SCHEMBL14868250 0.84 HIF1A (0.48) HIF1AMAPTALDH1A1GAAKDM4E
SCHEMBL5515739 0.76 HIF1A (0.56) HIF1AMAPTALDH1A1GAAKDM4E
SCHEMBL30089752 0.74 HIF1A (0.74) HIF1AMAPTALDH1A1GAAKDM4E
SCHEMBL14868249 0.71 ALDH1A1 (0.62) HIF1AMAPTALDH1A1GAAKDM4E
SCHEMBL28666818 0.70 GAA (0.46) MAPTALDH1A1GAAKDM4EMEN1
SCHEMBL15176489 0.70 KDM4E (0.41) MAPTALDH1A1GAAKDM4EMEN1
SCHEMBL2711213 0.70 MAPT (0.68) MAPTALDH1A1GAAKDM4EKMT2A
SCHEMBL16057469 0.70 GAA (0.64) MAPTALDH1A1GAAKDM4EKMT2A
SCHEMBL25233068 0.68 ALOX12 (0.72) HIF1AMAPTALDH1A1GAAKDM4E
SCHEMBL22279019 0.67 HTT (0.52) HIF1AMAPTALDH1A1KDM4EMEN1

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
JP-59167293-A None JP disclosed
JP-S59167293-A THERMAL RECORDING MATERIAL RICOH CO LTD 1984-09-20 JP disclosed