SCHEMBL7367135

SCHEMBL7367135

COc1cc(NC(C)=O)ccc1-c1nc(C)c(-c2cccnc2)n1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.52
CYP11B2 P19099 1/20 0.52
AAK1 Q2M2I8 1/20 0.51
ATR Q13535 1/20 0.48
ALDH1A1 P00352 4/20 0.45
HPGD P15428 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MKNK1 Q9BUB5 1/20 0.45
MKNK2 Q9HBH9 1/20 0.45
EGFR P00533 1/20 0.45
FGFR1 P11362 1/20 0.45
KDR P35968 1/20 0.45
MEN1 O00255 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
ABL1 P00519 2/20 0.44
PDGFRB P09619 1/20 0.44
BCR P11274 1/20 0.44

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
SCHEMBL7374259 0.88 ABL1 (0.49) CYP11B1CYP11B2ATRALDH1A1HPGD
SCHEMBL7370057 0.84 LMNA (0.43) AAK1ATRMKNK1MKNK2EGFR
SCHEMBL7370838 0.83 MKNK1 (0.46) CYP11B1CYP11B2MKNK1MKNK2CYP3A4
SCHEMBL7370568 0.82 CYP3A4 (0.55) CYP11B1CYP11B2MKNK1MKNK2CYP3A4
SCHEMBL7372935 0.82 ALDH1A1 (0.58) ATRALDH1A1HPGDHSD17B10MEN1
SCHEMBL7372122 0.81 CYP11B1 (0.46) CYP11B1CYP11B2MKNK1MKNK2MEN1
SCHEMBL7370764 0.81 KDM4E (0.48) CYP11B1CYP11B2HSD17B10MKNK1MKNK2
SCHEMBL7366286 0.81 ABCB1 (0.49) ATRALDH1A1MKNK1MKNK2EGFR
SCHEMBL7373136 0.80 POLB (0.51) CYP11B1CYP11B2ALDH1A1HSD17B10MKNK1
SCHEMBL7372273 0.80 MKNK1 (0.43) CYP11B1CYP11B2HSD17B10MKNK1MKNK2

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