SCHEMBL6203802

SCHEMBL6203802

CCOC(=O)c1c(NC(=O)CN2CCCCC2)sc2c1CC(C)CC2

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.66
MEN1 O00255 5/20 0.66
KMT2A Q03164 5/20 0.66
MAPT P10636 5/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
TSHR P16473 3/20 0.66
HPGD P15428 3/20 0.66
TP53 P04637 3/20 0.66
NPSR1 Q6W5P4 2/20 0.66
LMNA P02545 3/20 0.64
HSD17B10 Q99714 5/20 0.62
MAPK1 P28482 2/20 0.62
ALOX15 P16050 1/20 0.62
HTT P42858 2/20 0.58
USP2 O75604 1/20 0.58
KDM4E B2RXH2 3/20 0.57
CYBB P04839 1/20 0.52
NOX4 Q9NPH5 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52

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
SCHEMBL6202090 0.86 ALDH1A1 (0.79) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6203156 0.86 ALDH1A1 (0.82) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6200055 0.86 ALDH1A1 (0.82) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6203815 0.86 ALDH1A1 (0.79) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6205044 0.84 ALDH1A1 (0.84) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6203540 0.84 ALDH1A1 (0.80) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6203821 0.82 ALDH1A1 (0.84) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6201333 0.82 ALDH1A1 (0.65) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL21597710 0.80 KDM4E (0.69) ALDH1A1KMT2AMAPTSMN1; SMN2TSHR
SCHEMBL6203325 0.80 ALDH1A1 (0.76) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2

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 2781/4885MEN1 4773/4885KMT2A 3240/4885

“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.