SCHEMBL13097189

SCHEMBL13097189

Cc1c(COc2ccc3c(c2)N(C(=O)C2CCOCC2)CCC3)nc2ccc(F)cc2c1OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.41
OGG1 O15527 2/20 0.39
NME2 P22392 1/20 0.37
NMT2 O60551 1/20 0.37
NMT1 P30419 1/20 0.37
PDK1 Q15118 1/20 0.37
PDK2 Q15119 1/20 0.37
PDK3 Q15120 1/20 0.37
PDK4 Q16654 1/20 0.37
CYP11B2 P19099 2/20 0.37
KDM4E B2RXH2 3/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL13107227 0.91 OGG1 (0.39) RORCOGG1CYP11B2NPC1RAB9A
SCHEMBL13097191 0.91 RORC (0.42) RORCNME2NMT2NMT1PDK1
SCHEMBL13097184 0.88 DHODH (0.39) RORCMAPTALDH1A1DHODH
SCHEMBL13097194 0.85 RORC (0.45) RORCNMT2NMT1KDM4EHPGD
SCHEMBL13097203 0.85 CHRM4 (0.46) RORCNMT2NMT1KDM4EHPGD
SCHEMBL13106284 0.82 RORC (0.34) RORCCYP11B2KDM4EHPGDHSD17B10
SCHEMBL13097143 0.81 HRH3 (0.44) RORCNMT2NMT1KDM4EHPGD
SCHEMBL13097199 0.81 CHRM4 (0.42) RORCDHODH
SCHEMBL13106539 0.80 PIK3CG (0.37) MAPTDHODH
SCHEMBL13097126 0.79 RORC (0.42) RORCNMT2NMT1KDM4EHPGD

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-8367702-B2 Quinolone derivative ASTELLAS PHARMA INC. (JP) 2013-02-05 US disclosed
US-20100256113-A1 QUINOLONE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100256113-A1 QUINOLONE DERIVATIVE NQO1, NQO2, NADK RORC 1412/4885OGG1 1793/4885NME2 195/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.