SCHEMBL9670911

SCHEMBL9670911

Oc1nc2cc(Br)c3ccccc3c2nc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.49
MAX P61244 1/20 0.49
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
HTT P42858 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
PRNP P04156 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
NQO2 P16083 6/20 0.40
TP53 P04637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
HSP90AA1 P07900 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP2C19 P33261 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C9 P11712 2/20 0.36
ALOX15 P16050 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
SCHEMBL9670429 0.84 TYMS (0.41) MYCMAXALDH1A1MEN1KMT2A
SCHEMBL9671082 0.78 MYC (0.49) MYCMAXALDH1A1MEN1HTT
SCHEMBL9669736 0.75 MYC (0.50) MYCMAXKMT2AMAPTHPGD
SCHEMBL9671903 0.75 NQO2 (0.47) ALDH1A1SMN1; SMN2MAPTHPGDNQO2
SCHEMBL9670582 0.74 MYC (0.45) MYCMAXALDH1A1MEN1HTT
SCHEMBL9670624 0.72 EGFR (0.42) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL9669439 0.71 HPRT1 (0.51) MYCMAXALDH1A1MEN1HTT
SCHEMBL9578558 0.71 PRMT5 (0.49) MYCMAXALDH1A1KDM4EUSP2
SCHEMBL4705252 0.70 PIK3R1 (0.39) ALDH1A1MEN1HTTKMT2APRNP
SCHEMBL18573233 0.69 ALDH1A1 (0.45) MYCMAXALDH1A1MEN1HTT

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
US-4889855-A ADMINISTERING GLUTAMATE ANTAGONIST TO INHIBIT HYPERACTIVITY OF EXCITATORY NEUROTRANSMITTERS A/S FERROSAN (DK) 1989-12-26 US claimed
EP-0283959-B1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-01-02 EP disclosed
US-4912108-A Containing hydroxy substitution A/S FERROSAN (DK) 1990-03-27 US disclosed
US-4889855-A ADMINISTERING GLUTAMATE ANTAGONIST TO INHIBIT HYPERACTIVITY OF EXCITATORY NEUROTRANSMITTERS A/S FERROSAN (DK) 1989-12-26 US disclosed
EP-0283959-A1 Heterocyclic compounds and their preparation and use NOVO NORDISK A/S (DK) 1988-09-28 EP disclosed