SCHEMBL3895752

SCHEMBL3895752

Cc1ccc(C(=O)N(C)Cc2ccccc2)c(NS(=O)(=O)C2=CC=CN3SNC=C23)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.42
LIMK2 P53671 6/20 0.40
LIMK1 P53667 2/20 0.40
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KCNA5 P22460 5/20 0.38
MAPT P10636 2/20 0.38
TP53 P04637 1/20 0.38
KMT2A Q03164 3/20 0.38
HCRTR1 O43613 1/20 0.37
MEN1 O00255 1/20 0.36
ABL1 P00519 1/20 0.36
LCK P06239 1/20 0.36

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
SCHEMBL3903743 0.91 CCKBR (0.42) CCKBRLIMK2LIMK1POLBGAA
SCHEMBL3902490 0.91 CCKBR (0.53) CCKBRLIMK2LIMK1POLBGAA
SCHEMBL3902468 0.91 CCKBR (0.42) CCKBRLIMK2LIMK1POLBGAA
SCHEMBL3909921 0.91 KMT2A (0.42) CCKBRLIMK2LIMK1POLBGAA
SCHEMBL3911355 0.91 MAPT (0.44) CCKBRLIMK2LIMK1POLBGAA
SCHEMBL3901386 0.89 CCKBR (0.40) CCKBRLIMK2POLBGAATDP1
SCHEMBL3913066 0.86 CCKBR (0.45) CCKBRLIMK2LIMK1POLBGAA
SCHEMBL3902511 0.86 CCKBR (0.46) CCKBRLIMK2POLBGAATDP1
SCHEMBL3899767 0.86 KMT2A (0.35) MAPTKMT2AMEN1
SCHEMBL3911053 0.85 CRHBP (0.40) CCKBRGAAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1/4885LIMK2 1140/4885LIMK1 3166/4885
US-20040224983-A1 Benzo[1,2,5]thiadiazole compounds CCKBR, CCKAR, BRSK2 CCKBR 1/4885LIMK2 921/4885LIMK1 2869/4885

“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.