SCHEMBL3900341

SCHEMBL3900341

CC(NC(=O)c1ccc(C(F)(F)F)cc1NS(=O)(=O)C1=CC=CN2SNC=C12)c1ccc(Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 5/20 0.40
KDM1A O60341 1/20 0.38
ACLY P53396 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MCL1 Q07820 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
USP36 Q9P275 1/20 0.36
EEF2K O00418 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CCKAR P32238 1/20 0.33
CCKBR P32239 1/20 0.33
TMPRSS4 Q9NRS4 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
SCHEMBL5727829 0.92 L3MBTL1 (0.40) MEN1KMT2AL3MBTL1TDP1CCKAR
SCHEMBL3895742 0.92 L3MBTL1 (0.40) MEN1KMT2AL3MBTL1TDP1CCKAR
SCHEMBL3896549 0.90 L3MBTL1 (0.38) ACLYMEN1KMT2AL3MBTL1TDP1
SCHEMBL3906717 0.89 L3MBTL1 (0.38) ACLYMEN1KMT2AL3MBTL1TDP1
SCHEMBL3909962 0.89 L3MBTL1 (0.38) MEN1KMT2AL3MBTL1TDP1CCKAR
SCHEMBL3903757 0.89 L3MBTL1 (0.38) MEN1KMT2AL3MBTL1TDP1CCKAR
SCHEMBL3896537 0.89 L3MBTL1 (0.40) ACLYMEN1KMT2AL3MBTL1TDP1
SCHEMBL3899485 0.88 PDE2A (0.40) PDE2AKDM1AACLYMCL1
SCHEMBL3753898 0.85 KDM1A (0.39) KDM1AACLYMCL1USP36CCKAR
SCHEMBL3900169 0.85 CCR2 (0.37) L3MBTL1TDP1CCKARCCKBR

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 PDE2A 2948/4885KDM1A 3752/4885ACLY 4493/4885
US-20040224983-A1 Benzo[1,2,5]thiadiazole compounds CCKBR, CCKAR, BRSK2 PDE2A 2126/4885KDM1A 3148/4885ACLY 4421/4885

“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.