SCHEMBL6474641

SCHEMBL6474641

O=S(=O)(Nc1cccc(CCOCc2ccc(-c3cccc(C(F)(F)F)c3)cc2F)c1)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.40
KDM1A O60341 1/20 0.39
KIF11 P52732 2/20 0.39
MAOB P27338 2/20 0.38
IDH1 O75874 1/20 0.36
ERBB2 P04626 2/20 0.36
ERBB4 Q15303 2/20 0.36
CA2 P00918 1/20 0.36
MGLL Q99685 1/20 0.36
PLAU P00749 1/20 0.36
PLAT P00750 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
ERAP1 Q9NZ08 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
BACE1 P56817 1/20 0.34

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
SCHEMBL6482230 0.93 KIF11 (0.44) KDM1AKIF11IDH1ERBB2ERBB4
SCHEMBL6481112 0.89 KDM1A (0.41) KDM1AKIF11ERBB2ERBB4CA2
SCHEMBL6474335 0.89 KDM1A (0.39) KDM1AKIF11CA2PRMT6ERAP1
SCHEMBL6481745 0.88 EPHX2 (0.41) KDM1AKIF11IDH1CA2MGLL
SCHEMBL6474136 0.87 NAAA (0.40) NAAAKDM1AMAOBCA2PLAU
SCHEMBL6482513 0.86 CNR1 (0.39) KDM1AKIF11ERBB2ERBB4CA2
SCHEMBL6482076 0.86 KDM1A (0.38) KDM1AERBB2ERBB4CA2PLAU
SCHEMBL6483799 0.83 CA2 (0.39) KDM1ACA2PRMT6
SCHEMBL6474838 0.82 SHMT1 (0.37) KDM1ACA2
SCHEMBL6482520 0.81 KIF11 (0.46) KDM1AKIF11IDH1ERBB2ERBB4

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-6930131-B2 Aryl substituted 3-ethoxy phenyl trifluoromethane sulfonamides for the treatment of non-insulin dependent diabetes mellitus (NIDDM) WYETH (US) 2005-08-16 US disclosed
US-20030203941-A1 Substituted phenyl compounds for the treatment of non-insulin dependent diabetes mellitus WYETH (US) 2003-10-30 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-20030203941-A1 Substituted phenyl compounds for the treatment of non-insulin dependent diabetes mellitus GPR119, INSR, SLC5A1 NAAA 2563/4885KDM1A 1124/4885KIF11 3900/4885

“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.