SCHEMBL26790809

SCHEMBL26790809

CNc1c([N+](=O)[O-])ccc(Cl)c1F

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.47
VCAM1 P19320 8/20 0.44
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
ATM Q13315 1/20 0.38
PKM P14618 3/20 0.38
ALDH1A1 P00352 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
MMP13 P45452 1/20 0.37
PDE7A Q13946 1/20 0.36
LMNA P02545 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
SCHEMBL4876593 0.82 TDP1 (0.60) TDP1VCAM1TSHRMAPK1PKM
SCHEMBL944514 0.82 TDP1 (0.44) TDP1VCAM1TSHRMAPK1ATM
SCHEMBL8095455 0.81 HCAR3 (0.45) TDP1TSHRMAPK1ATMALDH1A1
SCHEMBL31257496 0.81 KMT2A (0.42) TDP1TSHRATMALDH1A1LMNA
SCHEMBL25592517 0.81 TDP1 (0.48) TDP1VCAM1TSHRMAPK1PKM
SCHEMBL25339286 0.79 ALDH1A1 (0.39) TDP1TSHRATMALDH1A1LMNA
SCHEMBL30273906 0.79 ALDH1A1 (0.39) TDP1TSHRATMALDH1A1LMNA
SCHEMBL25220217 0.78 TDP1 (0.42) TDP1VCAM1TSHRMAPK1ALDH1A1
SCHEMBL8013048 0.77 TDP1 (0.57) TDP1VCAM1TSHRMAPK1ATM
SCHEMBL30490230 0.77 TDP1 (0.57) TDP1VCAM1TSHRMAPK1ATM

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-20230374015-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR KINASES KINNATE BIOPHARMA INC. 2023-11-23 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-20230374015-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR KINASES FGFR1, FGFR2, FGFR3 TDP1 2063/4885VCAM1 1176/4885TSHR 1346/4885

“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.