SCHEMBL6541124

SCHEMBL6541124

CC1(C)OCC(Cc2ccc(S(=O)(=O)c3ccccc3)cc2)N1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.42
CA1 P00915 13/20 0.40
CA2 P00918 13/20 0.40
CA4 P22748 13/20 0.40
CA9 Q16790 13/20 0.40
ABCB1 P08183 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HTR6 P50406 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
SCHEMBL6541119 1.00 NAMPT (0.42) NAMPTCA1CA2CA4CA9
SCHEMBL6540195 0.91 CCR3 (0.37) NAMPTALDH1A1
SCHEMBL6540189 0.91 CCR3 (0.37) NAMPTALDH1A1
SCHEMBL6540934 0.89 PKM (0.44) NAMPTALDH1A1
SCHEMBL6540931 0.89 PKM (0.44) NAMPTALDH1A1
SCHEMBL6541597 0.88 KMT2A (0.38) CA1CA2CA4CA9ALDH1A1
SCHEMBL6541605 0.88 KMT2A (0.38) CA1CA2CA4CA9ALDH1A1
SCHEMBL6541438 0.83 CAPN1 (0.38) CA2ABCB1ALDH1A1HSD17B10
SCHEMBL6541442 0.83 CAPN1 (0.38) CA2ABCB1ALDH1A1HSD17B10
SCHEMBL6541230 0.83 ALDH1A1 (0.39) ABCB1ALDH1A1HSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 US disclosed
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 NAMPT 4409/4885CA1 4181/4885CA2 2242/4885

“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.