SCHEMBL9764909

SCHEMBL9764909

CCn1c2ccccc2c2cc(CNO)ccc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.63
ALDH1A1 P00352 4/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
KDM4E B2RXH2 7/20 0.62
LMNA P02545 4/20 0.62
MAPK1 P28482 3/20 0.62
POLB P06746 3/20 0.62
NPY5R Q15761 3/20 0.60
MAPT P10636 8/20 0.56
MEN1 O00255 4/20 0.56
HTT P42858 2/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 2/20 0.56
HBB P68871 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
NPSR1 Q6W5P4 2/20 0.55
RAB9A P51151 1/20 0.55
TP53 P04637 2/20 0.54
PRMT5 O14744 1/20 0.54
PKM P14618 1/20 0.52

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
SCHEMBL30148028 0.86 KMT2A (0.61) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL20181195 0.86 KMT2A (0.61) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL30523185 0.86 KMT2A (0.61) KMT2AALDH1A1L3MBTL1KDM4ELMNA
Hydrochloric Acid SCHEMBL19717434 0.85 KMT2A (0.60) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL14315376 0.84 NPY5R (0.64) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL4849333 0.83 KDM4E (0.67) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL13958870 0.82 KMT2A (0.67) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL10163400 0.82 KDM4E (0.66) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL12158838 0.82 KDM4E (0.66) KMT2AALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL30523163 0.81 KMT2A (0.64) KMT2AALDH1A1L3MBTL1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0422079-A4 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE 1991-08-21 EP disclosed
EP-0422079-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1991-04-17 EP disclosed
WO-1989012636-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1989-12-28 WO disclosed
EP-0346939-A1 Tricyclic lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-12-20 EP disclosed
US-4822811-A Carbazole lipoxygenase inhibiting compounds, compositions and use ABBOTT LABORATORIES (US) 1989-04-18 US disclosed