SCHEMBL24258162

SCHEMBL24258162

Oc1ccccc1C#CSI

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ CA4 P22748 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ CA12 O43570 1/20 0.38
▸ GMNN O75496 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ CA3 P07451 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ APEX1 P27695 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
SCHEMBL15688668 0.78 ALDH1A1 (0.53) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL5312824 0.74 ALDH1A1 (0.47) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL1808228 0.72 ALDH1A1 (0.45) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL17288705 0.70 ALDH1A1 (0.43) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL2045121 0.70 ALDH1A1 (0.43) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL25190694 0.70 FFAR1 (0.43) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL18286553 0.70 ALDH1A1 (0.43) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL673209 0.68 FFAR1 (0.59) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL6535306 0.68 FFAR1 (0.39) ALOX15ALDH1A1KDM4ENPC1CA2
SCHEMBL17443017 0.68 ALDH1A1 (0.53) ALOX15ALDH1A1KDM4ENPC1CA2

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 ALOX15 1153/4885ALDH1A1 4657/4885KDM4E 4779/4885

“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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