SCHEMBL3901443

SCHEMBL3901443

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

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.37
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CCKBR P32239 1/20 0.34
KDM4E B2RXH2 1/20 0.33
CCR1 P32246 1/20 0.33
LIMK2 P53671 2/20 0.33
ACLY P53396 1/20 0.33
USP2 O75604 2/20 0.32
USP8 P40818 2/20 0.32
CENPE Q02224 1/20 0.32
KDM1A O60341 1/20 0.32
MAPT P10636 1/20 0.31
TACR1 P25103 1/20 0.31

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
SCHEMBL3897304 0.93 KDM1A (0.40) CCKBRKDM4ECCR1ACLYKDM1A
SCHEMBL3901386 0.93 CCKBR (0.40) KMT2APOLBGAATDP1CCKBR
SCHEMBL3900438 0.89 CCKBR (0.44) KMT2APOLBGAATDP1CCKBR
SCHEMBL3896521 0.89 KMT2A (0.38) KMT2APOLBGAATDP1CCKBR
SCHEMBL3900281 0.89 KMT2A (0.38) KMT2APOLBGAATDP1CCKBR
SCHEMBL3909921 0.88 KMT2A (0.42) KMT2APOLBGAATDP1CCKBR
SCHEMBL3902422 0.86 ACLY (0.33) ACLYUSP2USP8KDM1A
SCHEMBL3902511 0.84 CCKBR (0.46) KMT2APOLBGAATDP1CCKBR
SCHEMBL3895752 0.82 CCKBR (0.42) KMT2APOLBGAATDP1CCKBR
SCHEMBL3905746 0.82 ACLY (0.49) KMT2AGAACCR1ACLYUSP2

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 KMT2A 3053/4885POLB 4576/4885GAA 3065/4885
US-20040224983-A1 Benzo[1,2,5]thiadiazole compounds CCKBR, CCKAR, BRSK2 KMT2A 3281/4885POLB 4671/4885GAA 3387/4885

“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.