SCHEMBL3982344

SCHEMBL3982344

COC(=O)c1c(NS(=O)(=O)c2ccccc2F)ccc(Br)c1OC

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
METAP2 P50579 3/20 0.44
ACLY P53396 5/20 0.43
FABP4 P15090 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
BRAF P15056 1/20 0.41
KMT2A Q03164 1/20 0.41
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.40
EDNRB P24530 1/20 0.40
EDNRA P25101 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL3988237 0.91 METAP2 (0.53) TSHRMETAP2ACLYFABP4
SCHEMBL3982432 0.89 TSHR (0.54) TSHRMETAP2ACLYALDH1A1KDM4E
SCHEMBL3982582 0.88 TSHR (0.47) TSHRMETAP2ACLYFABP4KMT2A
SCHEMBL3979797 0.87 TSHR (0.49) TSHRMETAP2ACLYALDH1A1KDM4E
SCHEMBL3988657 0.85 METAP2 (0.56) TSHRMETAP2ACLYFABP4ALDH1A1
SCHEMBL3988184 0.83 TSHR (0.47) TSHRMETAP2ACLYFABP4ALDH1A1
SCHEMBL1646666 0.81 POLB (0.38) TSHRALDH1A1KMT2APOLBMAPT
SCHEMBL3980835 0.79 METAP2 (0.56) TSHRMETAP2ACLYALDH1A1KDM4E
SCHEMBL3982813 0.79 METAP2 (0.52) TSHRMETAP2ACLYFABP4ALDH1A1
SCHEMBL3986601 0.78 METAP2 (0.53) TSHRMETAP2POLBSMN1; 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 5 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
EP-1549613-A1 SULFONAMIDES HAVING ANTIANGIOGENIC AND ANTICANCER ACTIVITY Abbott Laboratories (US) 2005-07-06 EP disclosed
US-20040167128-A1 Sulfonamides having antiangiogenic and anticancer activity ABBVIE INC. 2004-08-26 US disclosed
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity ABBOTT LABORATORIES 2004-08-12 US disclosed
WO-2004033419-A1 SULFONAMIDES HAVING ANTIANGIOGENIC AND ANTICANCER ACTIVITY ABBOTT LABORATORIES (US) 2004-04-22 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 (2 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-20040167128-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP TSHR 4446/4885METAP2 1/4885ACLY 2986/4885
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP TSHR 4446/4885METAP2 1/4885ACLY 2986/4885

“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.