SCHEMBL3981365

SCHEMBL3981365

CCc1cc(CC)c(OC)c(C(=O)O)c1NS(=O)(=O)c1ccccc1NCCCN1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 12/20 0.59
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KMT2A Q03164 1/20 0.43
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
AVPR1B P47901 1/20 0.42
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
DUSP3 P51452 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL3986679 0.89 METAP2 (0.70) METAP2KDM4EALDH1A1GAATSHR
SCHEMBL3986639 0.83 METAP2 (0.82) METAP2TSHRKMT2A
SCHEMBL3982252 0.81 METAP2 (0.78) METAP2
SCHEMBL3984448 0.81 METAP2 (0.69) METAP2
SCHEMBL3980768 0.81 METAP2 (0.79) METAP2
SCHEMBL3981501 0.81 METAP2 (0.63) METAP2
SCHEMBL3981445 0.81 METAP2 (0.77) METAP2
SCHEMBL3986520 0.81 METAP2 (0.72) METAP2
SCHEMBL3982738 0.81 METAP2 (0.64) METAP2TSHR
SCHEMBL3984603 0.80 METAP2 (0.81) METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7491718-B2 Sulfonamides having antiangiogenic and anticancer activity ABBOTT LABORATORIES (US) 2009-02-17 US disclosed
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity ABBOTT LABORATORIES 2004-08-12 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-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP METAP2 1/4885KDM4E 2363/4885ALDH1A1 3463/4885

“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.