SCHEMBL4139724

SCHEMBL4139724

CCCN(CCC)c1nsc2cccc(Cl)c12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 9/20 0.40
MAPT P10636 3/20 0.33
LMNA P02545 1/20 0.33
GHSR Q92847 1/20 0.32
PRKCI P41743 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH3A1 P30838 1/20 0.31
ALDH1A3 P47895 1/20 0.31
S1PR1 P21453 1/20 0.31
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
OGG1 O15527 1/20 0.30

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
SCHEMBL13903691 0.88 SMN1; SMN2 (0.37) LMNAGHSRPRKCIKDM4EALDH1A1
SCHEMBL13903783 0.87 PRKCI (0.38) CRHR1MAPTLMNAPRKCIKDM4E
SCHEMBL13903676 0.80 PRKCI (0.35) MAPTLMNAGHSRPRKCIKDM4E
SCHEMBL4128387 0.79 MAPK1 (0.33) MAPTLMNAPRKCIKDM4EALDH1A1
SCHEMBL13903778 0.77 GLP1R (0.33) MAPTLMNAPRKCIKDM4EALDH1A1
SCHEMBL15828126 0.76 MAPT (0.44) CRHR1MAPTKDM4EALDH1A1MAPK1
SCHEMBL10167449 0.75 ALDH1A1 (0.38) MAPTLMNAKDM4EALDH1A1MAPK1
SCHEMBL10167447 0.74 ALDH1A1 (0.40) MAPTLMNAKDM4EALDH1A1MAPK1
SCHEMBL10167434 0.74 ALDH1A1 (0.37) MAPTLMNAKDM4EALDH1A1MAPK1
SCHEMBL10167462 0.74 TP53 (0.38) MAPTLMNAKDM4EALDH1A1MAPK1

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-20090069317-A1 Insecticidal Methods Using 3-Amino-1,2-Benzisothiazole Derivatives BASF SE (DE) 2009-03-12 US disclosed
US-20090069317-A1 Insecticidal Methods Using 3-Amino-1,2-Benzisothiazole Derivatives BASF SE (DE) 2009-03-12 US disclosed
US-20090069317-A1 Insecticidal Methods Using 3-Amino-1,2-Benzisothiazole Derivatives BASF SE (DE) 2009-03-12 US disclosed
EP-1954138-A2 INSECTICIDAL METHODS USING 3-AMINO-1,2-BENZISOTHIAZOLE DERIVATIVES BASF SE (DE) 2008-08-13 EP disclosed
WO-2007057407-A2 INSECTICIDAL METHODS USING 3-AMINO-1,2-BENZISOTHIAZOLE DERIVATIVES BASF SE (DE) 2007-05-24 WO disclosed
WO-2007057407-A2 INSECTICIDAL METHODS USING 3-AMINO-1,2-BENZISOTHIAZOLE DERIVATIVES BASF SE (DE) 2007-05-24 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 (1 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-20090069317-A1 Insecticidal Methods Using 3-Amino-1,2-Benzisothiazole Derivatives AAAS, API5, ATL3 CRHR1 3974/4885MAPT 2683/4885LMNA 3264/4885

“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.