SCHEMBL25838143

SCHEMBL25838143

CCOC(=O)c1ccc(N=O)cc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
TSHR P16473 2/20 0.47
NPC1 O15118 3/20 0.45
PKM P14618 1/20 0.44
EGFR P00533 1/20 0.44
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 1/20 0.41
ATM Q13315 1/20 0.41
JMJD6 Q6NYC1 1/20 0.41
RAB9A P51151 1/20 0.40

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
SCHEMBL13061852 0.88 TSHR (0.47) CA12CA1CA2CA7CA9
SCHEMBL9859451 0.85 CA12 (0.45) CA12CA1CA2CA7CA9
SCHEMBL9859488 0.84 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL367075 0.80 TSHR (0.57) CA12CA1CA2CA7CA9
SCHEMBL7222675 0.80 TSHR (0.53) CA12CA1CA2CA7CA9
SCHEMBL13061850 0.79 TSHR (0.49) CA12CA1CA2CA7CA9
SCHEMBL11695717 0.79 TSHR (0.52) CA12CA1CA2CA7CA9
SCHEMBL927276 0.79 CA12 (0.70) CA12CA1CA2CA7CA9
SCHEMBL719657 0.78 DGAT1 (0.54) CA12CA1CA2CA7CA9
SCHEMBL539982 0.78 MAP2K1 (0.55) CA12CA1CA2CA7CA9

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-20230226228-A1 POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR DETECTION OF BACTERIAL INFECTION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-07-20 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-20230226228-A1 POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR DETECTION OF BACTERIAL INFECTION TLR5, SLC10A2, FNTB CA12 309/4885CA1 1393/4885CA2 558/4885

“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.