SCHEMBL6540891

SCHEMBL6540891

CC1(C)OCC(Cc2ccc(Sc3ccc(F)cc3)cc2)N1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.35
CACNA1G O43497 2/20 0.35
MMP1 P03956 1/20 0.34
MMP13 P45452 1/20 0.34
CYP26A1 O43174 1/20 0.34
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC6A9 P48067 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
SCHEMBL6540884 1.00 CCR3 (0.35) CCR3CACNA1GMMP1MMP13CYP26A1
SCHEMBL6541230 0.91 ALDH1A1 (0.39) CYP26A1
SCHEMBL6541226 0.91 ALDH1A1 (0.39) CYP26A1
SCHEMBL6539664 0.86 PTGIR (0.41) CACNA1GMEN1KMT2ASLC6A9
SCHEMBL6540189 0.86 CCR3 (0.37) CCR3CACNA1GTP53MEN1KMT2A
SCHEMBL6540195 0.86 CCR3 (0.37) CCR3CACNA1GTP53MEN1KMT2A
SCHEMBL6540261 0.81 ALOX5 (0.32)
SCHEMBL6540273 0.81 ALOX5 (0.32)
SCHEMBL6541438 0.81 CAPN1 (0.38) CACNA1GKMT2A
SCHEMBL6541442 0.81 CAPN1 (0.38) CACNA1GKMT2A

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 CCR3 1167/4885CACNA1G 1691/4885MMP1 2434/4885

“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.