SCHEMBL6200055

SCHEMBL6200055

CCOC(=O)c1c(NC(=O)CN2CCCCC2)sc2c1CCCC2

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.82
TSHR P16473 6/20 0.82
HSD17B10 Q99714 4/20 0.82
ALOX15 P16050 2/20 0.82
MAPK1 P28482 1/20 0.82
MAPT P10636 6/20 0.76
HPGD P15428 4/20 0.76
SMN1; SMN2 Q16637 4/20 0.76
NPSR1 Q6W5P4 3/20 0.76
MEN1 O00255 3/20 0.76
KMT2A Q03164 3/20 0.76
TP53 P04637 2/20 0.76
KDM4E B2RXH2 3/20 0.69
LMNA P02545 2/20 0.69
GAA P10253 1/20 0.68
TLR2 O60603 4/20 0.67
HTT P42858 1/20 0.67
CNR2 P34972 2/20 0.66
CYBB P04839 1/20 0.64
NOX4 Q9NPH5 1/20 0.64

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
SCHEMBL6203156 1.00 ALDH1A1 (0.82) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6205044 0.99 ALDH1A1 (0.84) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6203815 0.98 ALDH1A1 (0.79) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6202090 0.98 ALDH1A1 (0.79) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6203821 0.97 ALDH1A1 (0.84) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6203540 0.97 ALDH1A1 (0.80) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6201070 0.91 ALDH1A1 (0.70) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL3980443 0.90 ALDH1A1 (1.00) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6263808 0.90 CNR2 (0.73) ALDH1A1TSHRHSD17B10ALOX15MAPK1
SCHEMBL6203325 0.89 ALDH1A1 (0.76) ALDH1A1TSHRHSD17B10ALOX15MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509514-A1 ANTHELMINTIC AND INSECTICIDAL THIOPHENE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2005-03-02 EP claimed
US-20040014740-A1 Novel anthelmintic and insecticidal compositions PHARMACIA & UPJOHN COMPANY 2004-01-22 US claimed
WO-2003101979-A1 ANTHELMINTIC AND INSECTICIDAL THIOPHENE DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2003-12-11 WO claimed
EP-1509514-A1 ANTHELMINTIC AND INSECTICIDAL THIOPHENE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2005-03-02 EP disclosed
US-20040014740-A1 Novel anthelmintic and insecticidal compositions PHARMACIA & UPJOHN COMPANY 2004-01-22 US disclosed
WO-2003101979-A1 ANTHELMINTIC AND INSECTICIDAL THIOPHENE DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2003-12-11 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-20040014740-A1 Novel anthelmintic and insecticidal compositions ACHE, BCHE, AADAC ALDH1A1 2781/4885TSHR 4483/4885HSD17B10 2695/4885

“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.