SCHEMBL3984352

SCHEMBL3984352

Nc1ccc(Br)c(Cl)c1C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.47
KMT2A Q03164 3/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
TSHR P16473 1/20 0.47
ALDH1A1 P00352 6/20 0.45
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.44
PRKCZ Q05513 2/20 0.42
MAPT P10636 3/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAOB P27338 1/20 0.41
ADORA2A P29274 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 1/20 0.41
NPC1 O15118 1/20 0.40
THRB P10828 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 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
SCHEMBL3981567 0.83 RAB9A (0.49) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL3980607 0.81 KMT2A (0.45) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL9683658 0.78 TDP1 (0.51) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL914503 0.78 TDP1 (0.47) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL31636376 0.76 TDP1 (0.59) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL29562425 0.75 KMT2A (0.47) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL913073 0.75 KMT2A (0.47) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL26695099 0.74 KMT2A (0.63) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL23812473 0.74 TDP1 (0.61) TDP1KMT2ASLC6A2SLC6A3TSHR
SCHEMBL17965803 0.74 TDP1 (0.61) TDP1KMT2ASLC6A2SLC6A3TSHR

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 TDP1 3481/4885KMT2A 647/4885SLC6A2 1331/4885
US-20040157836-A1 Sulfonamides having antiangiogenic and anticancer activity METAP2, METAP1, DNPEP TDP1 3481/4885KMT2A 647/4885SLC6A2 1331/4885

“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.