SCHEMBL15623971

SCHEMBL15623971

Cc1cc(-c2nc3ccc(N)cn3c2NCc2ccccc2)no1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 19/20 0.54
BRD4 O60885 1/20 0.49

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
SCHEMBL1966091 0.88 BRD4 (0.64) NR1H4BRD4
SCHEMBL1970518 0.69 KDM4E (0.45) NR1H4BRD4
SCHEMBL1966925 0.68 GAA (0.63) BRD4
SCHEMBL16416647 0.67 BRD4 (0.82) NR1H4BRD4
SCHEMBL16415675 0.66 BRD4 (1.00) NR1H4BRD4
SCHEMBL19464184 0.66 NR1H4 (0.76) NR1H4
SCHEMBL13905557 0.65 NR1H4 (1.00) NR1H4
SCHEMBL2611932 0.65 NR1H4 (0.69) NR1H4
SCHEMBL17659150 0.64 ALDH1A1 (0.42) NR1H4
Acetic Acid SCHEMBL19463936 0.64 NR1H4 (0.70) NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334675-B1 IMIDAZOPYRIDINES AND IMIDAZOPYRIMIDINES AS HIV-I REVERSE TRANSCRIPTASE INHIBITORS CSIR (ZA) 2014-03-26 EP disclosed