SCHEMBL8718669

SCHEMBL8718669

O=Cc1c(Cl)n(Cc2ccc(Cl)cc2)c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.69
ALDH1A1 P00352 3/20 0.69
MEN1 O00255 3/20 0.69
KMT2A Q03164 3/20 0.69
KDM4E B2RXH2 1/20 0.69
USP2 O75604 1/20 0.69
POLB P06746 1/20 0.69
PSMD14 O00487 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
MAPK10 P53779 1/20 0.51
NPSR1 Q6W5P4 2/20 0.47
HTT P42858 2/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NOD2 Q9HC29 1/20 0.47
CYP19A1 P11511 1/20 0.46

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
SCHEMBL2345535 0.91 KMT2A (0.60) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL8718675 0.86 MAPT (0.59) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL8717326 0.85 P2RX4 (0.63) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL13228922 0.82 VDR (0.57) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL8717949 0.81 ALDH1A1 (0.70) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL30616069 0.78 CYP19A1 (0.73) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL29093702 0.78 CYP19A1 (0.73) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL23421206 0.78 LMNA (0.50) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL8713413 0.77 ALDH1A1 (0.53) LMNAALDH1A1MEN1KMT2AKDM4E
SCHEMBL96143 0.75 MEN1 (0.56) LMNAALDH1A1MEN1KMT2AKDM4E

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-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