SCHEMBL6540189

SCHEMBL6540189

CC1(C)OC[C@H](Cc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)N1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.37
NAMPT P43490 4/20 0.37
ALDH1A1 P00352 2/20 0.36
EGFR P00533 2/20 0.36
ERBB2 P04626 2/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 1/20 0.35
CACNA1G O43497 1/20 0.35

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
SCHEMBL6540195 1.00 CCR3 (0.37) CCR3NAMPTALDH1A1EGFRERBB2
SCHEMBL6541124 0.91 NAMPT (0.42) NAMPTALDH1A1
SCHEMBL6541119 0.91 NAMPT (0.42) NAMPTALDH1A1
SCHEMBL6540931 0.86 PKM (0.44) NAMPTALDH1A1EGFRERBB2MEN1
SCHEMBL6540934 0.86 PKM (0.44) NAMPTALDH1A1EGFRERBB2MEN1
SCHEMBL6540891 0.86 CCR3 (0.35) CCR3MEN1KMT2ATP53CACNA1G
SCHEMBL6540884 0.86 CCR3 (0.35) CCR3MEN1KMT2ATP53CACNA1G
SCHEMBL6541605 0.81 KMT2A (0.38) ALDH1A1MEN1KMT2A
SCHEMBL6541597 0.81 KMT2A (0.38) ALDH1A1MEN1KMT2A
SCHEMBL6541438 0.81 CAPN1 (0.38) ALDH1A1MAPTKMT2ACACNA1G

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-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 CCR3 1167/4885NAMPT 4409/4885ALDH1A1 188/4885

“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.