SCHEMBL9532647

SCHEMBL9532647

Oc1nc2ccc3nccnc3c2nc1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 6/20 0.37
ADRA2C P18825 5/20 0.37
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
ADRA1A P35348 4/20 0.37
ADRA2B P18089 4/20 0.37
ADRA1D P25100 4/20 0.37
ADRA1B P35368 3/20 0.37
MAPT P10636 4/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 4/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
LMNA P02545 1/20 0.35
MMP2 P08253 1/20 0.33
CHRM1 P11229 1/20 0.33
TSHR P16473 1/20 0.33
COMT P21964 1/20 0.33
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33

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
SCHEMBL30335572 0.78 MAPT (0.50) ADRA2AADRA2CMEN1KMT2AADRA1A
SCHEMBL29463681 0.78 MAPT (0.50) ADRA2AADRA2CMEN1KMT2AADRA1A
SCHEMBL87693 0.78 MAPT (0.50) ADRA2AADRA2CMEN1KMT2AADRA1A
SCHEMBL9671767 0.78 LMNA (0.61) MEN1KMT2AADRA1AMAPTKDM4E
SCHEMBL9533409 0.76 MAPT (0.50) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL30716827 0.75 MAPT (0.48) ADRA2AADRA2CMEN1KMT2AADRA1A
SCHEMBL16094567 0.74 MAPT (0.48) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL28714416 0.71 MEN1 (0.38) ADRA2AADRA2CMEN1KMT2AADRA1A
SCHEMBL3237025 0.70 MEN1 (0.40) ADRA2AADRA2CMEN1KMT2AADRA1A
SCHEMBL9534757 0.69 MMP14 (0.33) MEN1KMT2AMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5079250-A TRICYCLIC HETEROCYCLIC DIOLS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-01-07 US claimed
EP-0348872-B1 FUSED DIHYDROXYQUINOXALINES AND THEIR USE AS GLUTAMATE ANTAGONISTS NOVO NORDISK A/S (DK) 1993-09-29 EP disclosed
US-5109001-A Treating hyperactivity of excitatory neurotransmitters NOVO NORDISK A/S (DK) 1992-04-28 US disclosed
US-5079250-A TRICYCLIC HETEROCYCLIC DIOLS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-01-07 US disclosed
US-5075306-A Nervous system, psychological disorders NOVO NORDISK A/S (DK) 1991-12-24 US disclosed
US-5057516-A Nervous system disorders NOVO NORDISK A/S (DK) 1991-10-15 US disclosed
US-4977155-A Nervous system disorders A/S FERROSAN (DK) 1990-12-11 US disclosed
EP-0348872-A1 Fused dihydroxyquinoxalines and their use as glutamate antagonists NOVO NORDISK A/S (DK) 1990-01-03 EP disclosed