SCHEMBL6086148

SCHEMBL6086148

CCOC(=O)c1c(OS(=O)(=O)C(F)(F)F)c2cc(Cl)ccc2n(Cc2ccc(OC)cc2)c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
FEN1 P39748 1/20 0.47
MAPT P10636 4/20 0.45
LMNA P02545 4/20 0.45
TSHR P16473 3/20 0.45
PKM P14618 3/20 0.45
MAPK1 P28482 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
PMP22 Q01453 2/20 0.45
MEN1 O00255 1/20 0.45
RGS12 O14924 1/20 0.45
NFKB1 P19838 1/20 0.45
GNAI1 P63096 1/20 0.45
KMT2A Q03164 1/20 0.45
HIF1A Q16665 1/20 0.45
CCR2 P41597 1/20 0.43
PLA2G2A P14555 1/20 0.43

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
SCHEMBL31469810 0.83 ALDH1A1 (0.52) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL6086588 0.83 ALDH1A1 (0.59) ALDH1A1FEN1MAPTLMNATSHR
SCHEMBL6087197 0.82 ALDH1A1 (0.73) ALDH1A1FEN1MAPTLMNATSHR
SCHEMBL13041384 0.75 TP53 (0.45) ALDH1A1MAPTLMNANFKB1KMT2A
SCHEMBL5531289 0.73 ALDH1A1 (0.74) ALDH1A1FEN1MAPTLMNATSHR
SCHEMBL1061448 0.73 L3MBTL1 (0.65) ALDH1A1FEN1LMNAMAPK1MEN1
SCHEMBL5529505 0.73 ALDH1A1 (0.81) ALDH1A1MAPTLMNATSHRPKM
SCHEMBL25111402 0.72 KDM4E (0.47) ALDH1A1MAPTLMNATSHRPKM
SCHEMBL30099640 0.72 KDM4E (0.47) ALDH1A1MAPTLMNATSHRPKM
SCHEMBL1996313 0.72 ALDH1A1 (0.52) ALDH1A1FEN1MAPTLMNATSHR

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-7019141-B2 Quinolones with anti-HIV activity IRM LLC (BM) 2006-03-28 US disclosed
US-20040152719-A1 Quinolones with anti-HIV activity IRM LLC, A DELAWARE LLC (BM) 2004-08-05 US disclosed
WO-2004037853-A2 QUINOLONES WITH ANTI-HIV ACTIVITY IRM LLC (BM) 2004-05-06 WO 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-20040152719-A1 Quinolones with anti-HIV activity NQO2, QTRT1, DHX35 ALDH1A1 3344/4885FEN1 985/4885MAPT 2601/4885

“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.