SCHEMBL29640419

SCHEMBL29640419

Oc1cccc(C#Cc2ccc(O)c(O)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.59
CA2 P00918 3/20 0.59
CA9 Q16790 3/20 0.59
CA1 P00915 2/20 0.59
FFAR1 O14842 2/20 0.50
GRM5 P41594 2/20 0.46
HNF4A P41235 1/20 0.46
LCK P06239 1/20 0.46
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 2/20 0.44
CA14 Q9ULX7 2/20 0.44
LMNA P02545 1/20 0.44
CA5A P35218 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
HSD17B1 P14061 2/20 0.42
HSD17B2 P37059 2/20 0.42
APP P05067 1/20 0.40
IKBKB O14920 1/20 0.39
PGK1 P00558 1/20 0.38

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
SCHEMBL18130072 1.00 CA12 (0.59) CA12CA2CA9CA1FFAR1
SCHEMBL718295 0.87 CA12 (0.60) CA12CA2CA9CA1FFAR1
SCHEMBL18130059 0.84 APP (0.48) CA12CA2CA9CA1HNF4A
SCHEMBL4267311 0.83 HNF4A (0.63) CA12CA2CA9CA1FFAR1
SCHEMBL29640427 0.83 HNF4A (0.63) CA12CA2CA9CA1FFAR1
SCHEMBL12289090 0.83 CA12 (0.62) CA12CA2CA9CA1FFAR1
SCHEMBL4267440 0.83 ALOX5 (0.43) CA12CA2CA9CA1HNF4A
SCHEMBL722068 0.80 CA12 (0.59) CA12CA2CA9CA1FFAR1
SCHEMBL30940362 0.80 APP (0.54) CA12CA2CA9CA1HNF4A
SCHEMBL18130066 0.80 APP (0.54) CA12CA2CA9CA1HNF4A

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
EP-3280402-B1 TOLAN COMPOUNDS FOR PROMOTING WOUND HEALING BIOMENDICS LLC (US) 2024-06-05 EP disclosed
US-11351126-B2 Substituted tolans for the modulation of microbial colonization BioMendics, LLC (US) 2022-06-07 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-11351126-B2 Substituted tolans for the modulation of microbial colonization LMAN1, DPM1, DSTN CA12 4823/4885CA2 4202/4885CA9 4291/4885

“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.