SCHEMBL10117833

SCHEMBL10117833

CC(=O)Nc1nc(-c2ccccc2)c(Br)c(=O)[nH]1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.57
FGFR2 P21802 3/20 0.57
XDH P47989 1/20 0.55
ALDH1A1 P00352 4/20 0.51
POLB P06746 2/20 0.51
ALOX15 P16050 1/20 0.51
LMNA P02545 2/20 0.48
KDM4E B2RXH2 3/20 0.45
GAA P10253 2/20 0.45
NR4A2 P43354 1/20 0.45
MAPT P10636 1/20 0.45
ACMSD Q8TDX5 1/20 0.44
GDA Q9Y2T3 1/20 0.44
TSHR P16473 1/20 0.43
ADORA3 P0DMS8 2/20 0.43
TDP1 Q9NUW8 1/20 0.42
ADORA1 P30542 2/20 0.42
FGFR3 P22607 1/20 0.41

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
SCHEMBL510766 0.82 ALDH1A1 (0.52) XDHALDH1A1POLBLMNAKDM4E
SCHEMBL8016483 0.80 HTR6 (0.57) FGFR1FGFR2ALDH1A1POLBALOX15
SCHEMBL508892 0.78 CYP1A2 (0.48) XDHALDH1A1LMNAGAAACMSD
SCHEMBL8677237 0.72 XDH (0.68) XDHALDH1A1POLBKDM4EMAPT
SCHEMBL4525328 0.72 FGFR1 (0.54) FGFR1FGFR2XDHALDH1A1POLB
Bropirimine SCHEMBL509127 0.71 XDH (1.00) FGFR1FGFR2XDHALDH1A1KDM4E
SCHEMBL18041785 0.70 TGFBR1 (0.52) ALDH1A1POLBLMNAKDM4EADORA3
SCHEMBL1031056 0.69 FGFR1 (0.48) FGFR1FGFR2ALDH1A1POLBALOX15
SCHEMBL14960337 0.67 FGFR1 (0.55) FGFR1FGFR2ALDH1A1POLBALOX15
SCHEMBL13539588 0.67 POLB (0.47) FGFR1FGFR2ALDH1A1POLBALOX15

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-8211863-B2 Administration of TLR7 ligands and prodrugs thereof for treatment of infection by hepatitis C virus ANADYS PHARMACEUTICALS, INC. (US) 2012-07-03 US disclosed
US-20120028999-A1 ADMINISTRATION OF TLR7 LIGANDS AND PRODRUGS THEREOF FOR TREATMENT OF INFECTION BY HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2012-02-02 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-20120028999-A1 ADMINISTRATION OF TLR7 LIGANDS AND PRODRUGS THEREOF FOR TREATMENT OF INFECTION BY HEPATITIS C VIRUS TLR7, TLR3, TLR9 FGFR1 934/4885FGFR2 1937/4885XDH 957/4885

“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.