SCHEMBL3900812

SCHEMBL3900812

CN(Cc1ccc(F)cc1Cl)C(=O)c1ccc(Br)cc1NS(=O)(=O)C1=CC=CN2SNC=C12

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CCKBR P32239 4/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
HAO1 Q9UJM8 1/20 0.30
CCR2 P41597 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
SCHEMBL3900463 0.93 MEN1 (0.33) MEN1KMT2ACCKBR
SCHEMBL3902440 0.93 CCKBR (0.38) MEN1KMT2ACCKBRCRHBPCRHR2
SCHEMBL3905799 0.93 CRHBP (0.38) MEN1KMT2ACCKBRCRHBPCRHR2
SCHEMBL3907638 0.92 KMT2A (0.34) MEN1KMT2ACCKBRCRHBPCRHR2
SCHEMBL3913074 0.91 MEN1 (0.32) MEN1KMT2ACCKBRCRHBPCRHR2
SCHEMBL3908975 0.90 KMT2A (0.38) MEN1KMT2ACCKBRCRHBPCRHR2
SCHEMBL3900281 0.89 KMT2A (0.38) KMT2ACCKBR
SCHEMBL3902433 0.88 CRHBP (0.36) MEN1KMT2ACCKBRCRHBPCRHR2
SCHEMBL3906317 0.87 CCR2 (0.39) MEN1KMT2ACCKBRCRHBPCRHR2
SCHEMBL3901168 0.87 CRHBP (0.40) MEN1KMT2ACCKBRCRHBPCRHR2

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 MEN1 2768/4885KMT2A 3053/4885CCKBR 1/4885
US-20040224983-A1 Benzo[1,2,5]thiadiazole compounds CCKBR, CCKAR, BRSK2 MEN1 2441/4885KMT2A 3281/4885CCKBR 1/4885

“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.