SCHEMBL20106765

SCHEMBL20106765

O=C1Cc2cc(I)cc(Cl)c2N1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AHR P35869 5/20 0.53
TDP2 O95551 5/20 0.46
CMA1 P23946 2/20 0.41
GRIA1 P42261 4/20 0.36
CACNG8 Q8WXS5 4/20 0.36
CYP1A2 P05177 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
CACNG2 Q9Y698 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
ALOX12 P18054 1/20 0.35
KMT2A Q03164 1/20 0.35
PGR P06401 1/20 0.34
GRM5 P41594 1/20 0.34
PDK2 Q15119 1/20 0.33
SMYD3 Q9H7B4 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
SCHEMBL25066324 0.81 AHR (0.56) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL20112858 0.78 TDP2 (0.46) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL20106766 0.78 TDP2 (0.46) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL18189576 0.78 AHR (0.53) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL1163301 0.78 AHR (0.53) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL6411297 0.78 AHR (0.53) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL20106900 0.75 TDP2 (0.44) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL25899903 0.74 AHR (0.49) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL20085519 0.74 AHR (0.49) AHRTDP2CMA1GRIA1CACNG8
SCHEMBL20106901 0.74 TDP2 (0.42) AHRTDP2CMA1PGRGRM5

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-3532477-B1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-08-26 EP disclosed
EP-3532476-B1 FUSED AZAHETEROCYCLIC COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-08-19 EP disclosed
WO-2018080917-A1 FUSED BICYLIC PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO disclosed
WO-2018080918-A1 3-ARYL-2H-PYRAZOLO[4,3-B]PYRIDINE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO disclosed
WO-2018080916-A1 FUSED AZAHETEROCYCLIC COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO disclosed