SCHEMBL3897448

SCHEMBL3897448

CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(Br)cc1NS(=O)(=O)C1=CC=CN2SNC=C12

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 7/20 0.41
CCKAR P32238 3/20 0.34
METAP2 P50579 1/20 0.33
FLT1 P17948 4/20 0.32
FLT4 P35916 4/20 0.32
KDR P35968 4/20 0.32
SLC10A2 Q12908 1/20 0.32
SLC10A1 Q14973 1/20 0.32
SLC10A6 Q3KNW5 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HSP90AA1 P07900 2/20 0.31
LIMK2 P53671 2/20 0.31
ALDH1A1 P00352 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL3902511 0.94 CCKBR (0.46) CCKBRCCKARPOLBGAATDP1
SCHEMBL3900281 0.92 KMT2A (0.38) CCKBRCCKARMETAP2POLBGAA
SCHEMBL3902468 0.92 CCKBR (0.42) CCKBRCCKARPOLBGAATDP1
SCHEMBL3901201 0.91 CCKBR (0.41) CCKBRCCKARPOLBGAATDP1
SCHEMBL3905799 0.90 CRHBP (0.38) CCKBRCCKARMETAP2FLT1FLT4
SCHEMBL3900438 0.89 CCKBR (0.44) CCKBRCCKARPOLBGAATDP1
SCHEMBL3902490 0.89 CCKBR (0.53) CCKBRCCKARPOLBGAATDP1
SCHEMBL3897304 0.89 KDM1A (0.40) CCKBRCCKARFLT1FLT4KDR
SCHEMBL3900812 0.86 MEN1 (0.32) CCKBR
SCHEMBL3900463 0.85 MEN1 (0.33) CCKBR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241759-B2 Benzo[1,2,5]thiadiazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-10 US claimed
US-7550492-B2 Benzo[1,2,5]thiadiazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-06-23 US disclosed
US-20070276016-A1 BENZO[1,2,5]THIADIAZOLE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2007-11-29 US disclosed
US-7241759-B2 Benzo[1,2,5]thiadiazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-10 US disclosed
EP-1675837-A2 BENZO [1,2,5] THIADIAZOLE COMPOUNDS AS CCK2 MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-07-05 EP disclosed
WO-2005012275-A2 BENZO [1, 2, 5] THIADIAZOLE COMPOUNDS AS CCK2 MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-02-10 WO disclosed
US-20040224983-A1 Benzo[1,2,5]thiadiazole compounds JANSSEN PHARMACEUTICA, N.V. (BE) 2004-11-11 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 (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-20070276016-A1 BENZO[1,2,5]THIADIAZOLE COMPOUNDS CCKBR, CCKAR, GIPR CCKBR 1/4885CCKAR 2/4885METAP2 3335/4885
US-20040224983-A1 Benzo[1,2,5]thiadiazole compounds CCKBR, CCKAR, BRSK2 CCKBR 1/4885CCKAR 2/4885METAP2 3402/4885

“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.