SCHEMBL7373136

SCHEMBL7373136

COc1ccccc1-c1nc(C)c(-c2cccnc2)n1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
FYN P06241 1/20 0.48
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PDE10A Q9Y233 4/20 0.43
PDE2A O00408 2/20 0.43
PDE5A O76074 2/20 0.43
PDE11A Q9HCR9 2/20 0.43
PDE4A P27815 1/20 0.43
CYP11B1 P15538 3/20 0.42
CYP11B2 P19099 3/20 0.42
CYP17A1 P05093 2/20 0.42
CYP19A1 P11511 1/20 0.42
USP1 O94782 1/20 0.42
WDR48 Q8TAF3 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7368774 0.89 P2RX7 (0.50) POLBFYNALDH1A1MEN1KMT2A
SCHEMBL7372593 0.88 DHFR (0.43) ALDH1A1MEN1KMT2AGAAMAPT
SCHEMBL7370838 0.87 MKNK1 (0.46) MAPTPDE10APDE2APDE5APDE11A
SCHEMBL7376110 0.87 ADRA2A (0.45) POLBFYNPDE5ACYP11B1CYP11B2
SCHEMBL7370764 0.86 KDM4E (0.48) POLBMAPTPDE10APDE2APDE5A
SCHEMBL7365766 0.86 APLNR (0.45) POLBFYNALDH1A1MEN1KMT2A
SCHEMBL7370568 0.86 CYP3A4 (0.55) NPSR1CYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL7372635 0.86 CYP11B2 (0.52) ALDH1A1NPSR1PDE10APDE2APDE5A
SCHEMBL28766867 0.85 PTGS2 (0.43) POLBFYNMEN1KMT2ACYP11B2
SCHEMBL7369883 0.85 CYP11B1 (0.46) POLBMEN1KMT2APDE10APDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4822805-A ANTIINFLAMMATORY AGENTS, CARDIOTONIC AGENTS, ANTIPLATELET AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-04-18 US disclosed
EP-0257897-A1 Imidazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-03-02 EP disclosed