SCHEMBL31734751

SCHEMBL31734751

O=S1(=O)N=C(N[C@@H]2CC23CC3)Nc2ccc(F)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
ABCC8 Q09428 2/20 0.39
KCNJ11 Q14654 2/20 0.39
TAAR1 Q96RJ0 1/20 0.37
CXCR2 P25025 3/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
THRB P10828 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NT5E P21589 1/20 0.33

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
SCHEMBL31734787 1.00 CA12 (0.41) CA12CA1CA2CA4CA7
SCHEMBL31734758 0.95 ABCC8 (0.40) CA12CA1CA2CA4CA7
SCHEMBL31734770 0.86 L3MBTL1 (0.42) CA12CA1CA2CA4CA7
SCHEMBL31734742 0.86 L3MBTL1 (0.42) CA12CA1CA2CA4CA7
SCHEMBL7952015 0.82 CA12 (0.44) CA12CA1CA2CA4CA7
SCHEMBL31734766 0.81 ALDH1A1 (0.33) ABCC8KCNJ11CXCR2ALDH1A1LMNA
SCHEMBL31734802 0.81 ALDH1A1 (0.33) ABCC8KCNJ11CXCR2ALDH1A1LMNA
SCHEMBL31734779 0.81
SCHEMBL4262374 0.80 ABCC8 (0.45) CA12CA1CA2CA4CA7
SCHEMBL6554548 0.80 ABCC8 (0.48) CA12CA1CA2CA4CA7

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-20250360142-A1 NOVEL ATP-SENSITIVE POTASSIUM CHANNEL POTENTIATORS, THEIR PREPARATION AND USE RHYTHM PHARMACEUTICALS INC (US) 2025-11-27 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-20250360142-A1 NOVEL ATP-SENSITIVE POTASSIUM CHANNEL POTENTIATORS, THEIR PREPARATION AND USE KCNJ11, ATP1A2, ATP1A3 CA12 3754/4885CA1 3276/4885CA2 647/4885

“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.