SCHEMBL13097461

SCHEMBL13097461

Cc1c(COc2cccc(N3CCOCCC3=O)c2)nc2ccccc2c1OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.41
PRKDC P78527 4/20 0.41
ATM Q13315 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
P2RY12 Q9H244 1/20 0.39
NME2 P22392 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PIK3CG P48736 1/20 0.38
BCHE P06276 1/20 0.38
LIPC P11150 1/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL3091096 0.92 MAPT (0.43) DDB1CRBNMAPTALDH1A1PRKDC
SCHEMBL13097462 0.91 DDB1 (0.41) DDB1CRBNMAPTALDH1A1PRKDC
SCHEMBL13106340 0.90 ADAM17 (0.38) DDB1CRBNMAPTALDH1A1PRKDC
SCHEMBL13097414 0.90 PARP1 (0.45) MAPTALDH1A1LMNAHTTHSD17B10
SCHEMBL13097417 0.89 FFAR1 (0.45) MAPTNPC1RAB9ASMN1; SMN2MGLL
SCHEMBL13097421 0.88 FFAR1 (0.44) MAPTNPC1RAB9ASMN1; SMN2MGLL
SCHEMBL13097431 0.87 NAAA (0.46) DDB1CRBNMAPTALDH1A1HPGD
SCHEMBL13097085 0.87 PRKDC (0.44) MAPTALDH1A1PRKDCATMKDM4E
SCHEMBL13097459 0.84 MAPT (0.42) DDB1CRBNMAPTNPC1RAB9A
SCHEMBL13097446 0.84 MAP4K1 (0.42) DDB1CRBNMAPTALDH1A1PRKDC

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 DDB1 2911/4885CRBN 4221/4885MAPT 4661/4885

“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.