SCHEMBL1480140

SCHEMBL1480140

COc1cccc2snc(NCC(C)(C)c3cccc(C)n3)c12

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 8/20 0.69
GRM5 P41594 1/20 0.34
ASIC3 Q9UHC3 1/20 0.34
BACE1 P56817 1/20 0.34
NR3C1 P04150 1/20 0.33
EPAS1 Q99814 3/20 0.33
SGMS2 Q8NHU3 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CASR P41180 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
SCHEMBL1480555 0.81 KCNA5 (1.00) KCNA5EPAS1SGMS2
SCHEMBL1478047 0.78 KCNA5 (0.69) KCNA5GRM5ASIC3SGMS2
SCHEMBL292526 0.75 KCNA5 (0.64) KCNA5EPAS1SGMS2KDM4EMEN1
SCHEMBL1478645 0.72 KCNA5 (0.47) KCNA5GRM5ASIC3NR3C1
SCHEMBL2428789 0.71 KCNA5 (0.58) KCNA5BACE1EPAS1SGMS2KDM4E
SCHEMBL1479585 0.66 KCNA5 (0.47) KCNA5
SCHEMBL3402475 0.66 KCNA5 (0.48) KCNA5BACE1EPAS1KDM4EMEN1
SCHEMBL1480539 0.66 KCNA5 (0.67) KCNA5GRM5SGMS2
SCHEMBL2570453 0.66 DYRK1A (0.52) KCNA5BACE1EPAS1KDM4EMEN1
SCHEMBL18516917 0.64 CCR1 (0.43) GRM5KDM4EMEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017554-B2 3-amino-1,2-benzisothiazole compounds for combating animal pest BASF SE (DE) 2011-09-13 US claimed
US-20100167922-A1 3-Amino-1,2-benzisothiazole Compounds for Combating Animal Pest BASF SE (DE) 2010-07-01 US claimed
EP-2003975-B1 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST BASF SE (DE) 2009-11-18 EP claimed
US-8357809-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-22 US disclosed
US-8357809-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-22 US disclosed
US-8357809-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-22 US disclosed
US-20120094983-A1 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-04-19 US disclosed
US-20120094983-A1 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-04-19 US disclosed
US-20120094983-A1 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-04-19 US disclosed
US-7915410-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-29 US disclosed
US-7915410-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-29 US disclosed
US-7915410-B2 Acyclic IKur inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-29 US disclosed
EP-2003975-B1 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST BASF SE (DE) 2009-11-18 EP disclosed
EP-1922311-A2 ACYCLIC IKUR INHIBITORS Brystol-Myers Squibb Company (US) 2008-05-21 EP disclosed
US-20070082909-A1 Acyclic Ikur inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-12 US disclosed
US-20070082909-A1 Acyclic Ikur inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-12 US disclosed
US-20070082909-A1 Acyclic Ikur inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-04-12 US disclosed
WO-2007030582-A2 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-15 WO disclosed
WO-2007030582-A2 ACYCLIC IKUR INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-15 WO 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 (3 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-20070082909-A1 Acyclic Ikur inhibitors KCNH2, KCNJ2, KCNH3 KCNA5 67/4885GRM5 3038/4885ASIC3 394/4885
US-20100167922-A1 3-Amino-1,2-benzisothiazole Compounds for Combating Animal Pest BPNT1, AADAT, BCAT1 KCNA5 552/4885GRM5 370/4885ASIC3 718/4885
US-20120094983-A1 ACYCLIC IKUR INHIBITORS KCNH2, KCNJ2, KCNH3 KCNA5 67/4885GRM5 3038/4885ASIC3 394/4885

“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.