SCHEMBL8322845

SCHEMBL8322845

COC(=O)c1ccc(C/C=C/c2ncccc2OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
MAPT P10636 4/20 0.51
LMNA P02545 3/20 0.51
RAB9A P51151 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PPIA P62937 3/20 0.50
ALDH1A1 P00352 3/20 0.50
PKM P14618 2/20 0.50
HTT P42858 2/20 0.50
MEN1 O00255 3/20 0.49
POLB P06746 1/20 0.49
BLM P54132 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
GAA P10253 2/20 0.48
RXRA P19793 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 2/20 0.45
ATM Q13315 1/20 0.45
PTGER4 P35408 1/20 0.45

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
SCHEMBL8322849 1.00 KMT2A (0.56) KMT2AMAPTLMNARAB9AL3MBTL1
SCHEMBL8323855 0.89 PPIA (0.54) KMT2AMAPTPPIAALDH1A1RXRA
SCHEMBL8323857 0.89 PPIA (0.54) KMT2AMAPTPPIAALDH1A1RXRA
SCHEMBL8324434 0.88 KMT2A (0.55) KMT2AMAPTLMNARAB9AL3MBTL1
SCHEMBL8324432 0.88 KMT2A (0.55) KMT2AMAPTLMNARAB9AL3MBTL1
SCHEMBL8523359 0.85 KMT2A (0.62) KMT2AMAPTLMNARAB9AL3MBTL1
SCHEMBL8523361 0.85 KMT2A (0.62) KMT2AMAPTLMNARAB9AL3MBTL1
SCHEMBL30078173 0.83 KMT2A (0.63) KMT2AMAPTLMNARAB9AL3MBTL1
SCHEMBL15065516 0.83 KMT2A (0.63) KMT2AMAPTLMNARAB9AL3MBTL1
SCHEMBL8677984 0.79 KMT2A (0.49) KMT2ALMNAPPIAALDH1A1HTT

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-0733033-B1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LTD (GB) 1999-12-22 EP disclosed
EP-0733033-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-09-25 EP disclosed
WO-1996011902-A1 PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS ZENECA LIMITED (GB) 1996-04-25 WO disclosed