SCHEMBL30188162

SCHEMBL30188162

COc1ccc(NS(=O)(=O)c2ccccc2C#Cc2ccc(C(=O)O)nc2)c(C)c1C

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC16A3 O15427 20/20 0.65
▸ OPRD1 P41143 1/20 0.47
▸ HTR6 P50406 1/20 0.47
▸ SLC6A3 Q01959 1/20 0.47

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
SCHEMBL22116814 1.00 SLC16A3 (0.65) SLC16A3OPRD1HTR6SLC6A3
SCHEMBL30188045 0.90 SLC16A3 (0.75) SLC16A3OPRD1HTR6SLC6A3
SCHEMBL22116625 0.90 SLC16A3 (0.75) SLC16A3OPRD1HTR6SLC6A3
SCHEMBL22134727 0.84 SLC16A3 (0.60) SLC16A3
SCHEMBL30188121 0.84 SLC16A3 (0.60) SLC16A3
SCHEMBL22116655 0.83 SLC16A3 (0.58) SLC16A3
SCHEMBL30187817 0.83 SLC16A3 (0.58) SLC16A3
SCHEMBL22116541 0.82 SLC16A3 (0.82) SLC16A3OPRD1HTR6SLC6A3
SCHEMBL30188310 0.82 SLC16A3 (0.82) SLC16A3OPRD1HTR6SLC6A3
SCHEMBL22116627 0.81 SLC16A3 (0.63) SLC16A3

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-12351570-B2 Disubstituted alkyne derivatives MERCK PATENT GMBH (DE) 2025-07-08 — — US disclosed
US-20230052586-A1 DISUBSTITUTED ALKYNE DERIVATIVES MERCK PATENT GMBH (DE) 2023-02-16 — — 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 (2 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-12351570-B2 Disubstituted alkyne derivatives BRCA1, MYC, PCNA SLC16A3 3198/4885OPRD1 4628/4885HTR6 3513/4885
US-20230052586-A1 DISUBSTITUTED ALKYNE DERIVATIVES BRCA1, MYC, PCNA SLC16A3 3198/4885OPRD1 4628/4885HTR6 3513/4885

“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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