SCHEMBL8715136

SCHEMBL8715136

CCOC(=O)/C(C#N)=C\c1c(Cl)n(Cc2cccc(OC)c2)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
ALDH1A1 P00352 5/20 0.57
LMNA P02545 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
DHODH Q02127 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 2/20 0.48
THRB P10828 2/20 0.48
ATM Q13315 1/20 0.48
TSPO P30536 1/20 0.46
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44
APP P05067 1/20 0.44
SNCA P37840 1/20 0.44
PPARG P37231 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
NCOR2 Q9Y618 1/20 0.44
HPGD P15428 1/20 0.43

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
SCHEMBL8715138 1.00 MAPT (0.60) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8717517 0.91 MAPT (0.61) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8717514 0.91 MAPT (0.61) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8714215 0.90 MAPT (0.60) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8714219 0.90 MAPT (0.60) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8713366 0.90 MAPT (0.66) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8713370 0.90 MAPT (0.66) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8717977 0.86 MAPT (0.64) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8717976 0.86 MAPT (0.64) MAPTSMN1; SMN2ALDH1A1LMNANPSR1
SCHEMBL8714793 0.83 ALDH1A1 (0.60) MAPTSMN1; SMN2ALDH1A1LMNANPSR1

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-0843660-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-05-27 EP claimed
WO-1997005109-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-02-13 WO claimed
EP-0843660-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-05-27 EP disclosed
US-5696148-A POTENT ANTAGONIST OF METABOTROPIC GLUTAMATE RECEPTORS; TREATING EPILEPSY, PARKINSON'S DISEASE, HUNTINGTON'S DISEASE, BRAIN DISORDER AND ALZHEIMER'S DISEASE NOVO NORDISK A/S (DK) 1997-12-09 US disclosed
WO-1997005109-A1 HETEROCYCLIC COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-02-13 WO disclosed