SCHEMBL9720448

SCHEMBL9720448

COCc1c[c]cc(C)n1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 4/20 0.34
GAA P10253 1/20 0.34
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
PKM P14618 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL5604835 0.76
SCHEMBL9720562 0.74
SCHEMBL5604290 0.74
SCHEMBL9720444 0.72 KDM4E (0.33) KDM4E
SCHEMBL312626 0.71
SCHEMBL9720474 0.71 KDM4E (0.31) ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL13700992 0.70 LMNA (0.37) ALDH1A1KDM4EHPGDGAAHSD17B10
SCHEMBL790651 0.69 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDHSD17B10TDP1
SCHEMBL791993 0.68 CCR1 (0.44) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL12093365 0.68 NOS3 (0.41) ALDH1A1KDM4EHPGDGAAHSD17B10

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
US-5169853-A Antibacterial agents; administering to mammals for infection STERLING DRUG INC. (US) 1992-12-08 US disclosed
US-5075319-A Bactericides STERLING DRUG INC. (US) 1991-12-24 US disclosed
EP-0417669-A2 Pyridinyl-quinolone compounds, their preparation and use STERLING WINTHROP INC. (US) 1991-03-20 EP disclosed