SCHEMBL25925355

SCHEMBL25925355

Cc1ccc2c(c1)c(C#N)cn2CC(=O)O

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.66
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 1/20 0.52
PTGDR2 Q9Y5Y4 3/20 0.52
MAPT P10636 1/20 0.51
POLB P06746 1/20 0.50
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL25925358 0.82 MAPT (0.54) STAT3SMN1; SMN2GAAPTGDR2MAPT
SCHEMBL19208909 0.81 STAT3 (0.59) STAT3SMN1; SMN2GAAMAPTPOLB
SCHEMBL29781691 0.81 STAT3 (0.59) STAT3SMN1; SMN2GAAMAPTPOLB
SCHEMBL14884740 0.80 STAT3 (1.00) STAT3SMN1; SMN2MAPTPOLBALDH1A1
SCHEMBL25925010 0.77 SMN1; SMN2 (0.53) STAT3SMN1; SMN2PTGDR2MAPTPOLB
SCHEMBL3275549 0.74 PTGDR2 (0.70) GAAPTGDR2MAPTPOLBALDH1A1
SCHEMBL3275553 0.74 PTGDR2 (0.70) GAAPTGDR2MAPTPOLBALDH1A1
SCHEMBL14564434 0.72 KDM4E (0.47) PTGDR2MAPTPOLBALDH1A1KMT2A
SCHEMBL7293153 0.72 IMPDH2 (0.61) SMN1; SMN2
SCHEMBL16709583 0.72 PTGDR2 (0.50) STAT3PTGDR2POLBALDH1A1

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-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-07-13 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-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF C9, C5, C1QBP STAT3 2798/4885SMN1; SMN2 2279/4885GAA 641/4885

“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.