SCHEMBL3900438

SCHEMBL3900438

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

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 2/20 0.44
KMT2A Q03164 2/20 0.38
CCKAR P32238 1/20 0.37
CCR2 P41597 5/20 0.37
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LIMK2 P53671 3/20 0.34
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 1/20 0.33

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 0.95 CCKBR (0.46) CCKBRKMT2ACCKARCCR2POLB
SCHEMBL3902490 0.92 CCKBR (0.53) CCKBRKMT2ACCKARPOLBGAA
SCHEMBL3906317 0.91 CCR2 (0.39) CCKBRKMT2ACCKARCCR2LMNA
SCHEMBL3896521 0.91 KMT2A (0.38) CCKBRKMT2ACCKARPOLBGAA
SCHEMBL3900281 0.91 KMT2A (0.38) CCKBRKMT2ACCKARPOLBGAA
SCHEMBL3902440 0.90 CCKBR (0.38) CCKBRKMT2ACCKARCCR2LMNA
SCHEMBL3901443 0.89 KMT2A (0.37) CCKBRKMT2APOLBGAATDP1
SCHEMBL3897448 0.89 CCKBR (0.41) CCKBRCCKARPOLBGAATDP1
SCHEMBL3901201 0.89 CCKBR (0.41) CCKBRCCKARCCR2POLBGAA
SCHEMBL3909921 0.89 KMT2A (0.42) CCKBRKMT2ACCKARPOLBGAA

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

“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.