SCHEMBL7574776

SCHEMBL7574776

CCOC(=O)C1C(=O)C(=O)c2ccc(Br)c(OC(F)F)c2N1C1CC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
GAA P10253 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 4/20 0.34
TDP2 O95551 1/20 0.34
APAF1 O14727 1/20 0.34
SMAD3 P84022 1/20 0.34
MAPT P10636 2/20 0.34
KCNH2 Q12809 1/20 0.33
TSHR P16473 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL7584565 0.89 ALDH1A1 (0.41) ALDH1A1GAASMN1; SMN2KDM4ETDP2
SCHEMBL7585605 0.78 KDM4E (0.34) ALDH1A1GAASMN1; SMN2KDM4ETDP2
SCHEMBL4864333 0.75 TNF (0.36) ALDH1A1GAAKDM4EMAPTTSHR
SCHEMBL7576603 0.66 ALDH1A1 (0.37) ALDH1A1GAASMN1; SMN2KDM4ETDP2
SCHEMBL7513508 0.66 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2KDM4EKCNH2MEN1
SCHEMBL2081998 0.65 ADRB2 (0.45) MAPTKCNH2MEN1KMT2AHPGD
SCHEMBL7585608 0.64 APAF1 (0.32) SMN1; SMN2TDP2APAF1SMAD3MAPT
SCHEMBL31522062 0.61 MAPT (0.45) ALDH1A1GAASMN1; SMN2KDM4ETDP2
SCHEMBL2898740 0.61 TSHR (0.44) ALDH1A1GAASMN1; SMN2KDM4EMAPT
SCHEMBL7574847 0.59 TDP2 (0.48) ALDH1A1GAAKDM4ETDP2APAF1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials ABBOTT LABORATORIES 2002-04-25 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-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials NQO2, NQO1, NDUFA7 ALDH1A1 145/4885GAA 171/4885SMN1; SMN2 3221/4885

“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.