SCHEMBL24258142

SCHEMBL24258142

Oc1cccc(C#CSI)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.45
▸ CA2 P00918 3/20 0.45
▸ CA9 Q16790 3/20 0.45
▸ CA1 P00915 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ CA14 Q9ULX7 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CA5A P35218 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ CA5B Q9Y2D0 1/20 0.42
▸ FFAR1 O14842 2/20 0.41
▸ GRM5 P41594 2/20 0.41
▸ HSD17B13 Q7Z5P4 1/20 0.36
▸ HSD17B1 P14061 3/20 0.35
▸ HSD17B2 P37059 3/20 0.35
▸ ACHE P22303 3/20 0.35
▸ TSHR P16473 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CA7 P43166 1/20 0.35

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
SCHEMBL718295 0.80 CA12 (0.60) CA12CA2CA9CA1ALDH1A1
SCHEMBL28933385 0.76 CA12 (0.41) CA12CA2CA9CA1ALDH1A1
SCHEMBL24258157 0.74 APP (0.48) CA12CA2CA9CA1ALDH1A1
SCHEMBL30493627 0.74 CA12 (0.59) CA12CA2CA9CA1ALDH1A1
SCHEMBL722068 0.74 CA12 (0.59) CA12CA2CA9CA1ALDH1A1
SCHEMBL2814308 0.72 CA12 (0.49) CA12CA2CA9CA1ALDH1A1
SCHEMBL12289090 0.72 CA12 (0.62) CA12CA2CA9CA1ALDH1A1
SCHEMBL20489172 0.72 CA12 (0.49) CA12CA2CA9CA1ALDH1A1
SCHEMBL10035471 0.72 CA12 (0.49) CA12CA2CA9CA1ALDH1A1
SCHEMBL22163466 0.72 GRM5 (0.50) CA12CA2CA9CA1ALDH1A1

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-20230303493-A1 ANTIBACTERIAL ADJUVANTS AND APPLICATIONS THEREOF SAN JOSE STATE UNIVERSITY RESEARCH FOUNDATION 2023-09-28 — — US disclosed
WO-2022036208-A1 ANTIBACTERIAL ADJUVANTS AND APPLICATIONS THEREOF THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2022-02-17 — — WO 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-20230303493-A1 ANTIBACTERIAL ADJUVANTS AND APPLICATIONS THEREOF CAPG, SLC11A2, CAPRIN1 CA12 4192/4885CA2 3190/4885CA9 4390/4885

“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.

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