SCHEMBL376197

SCHEMBL376197

CN(C)CCCC[C@@H](N)CSc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
HTR2A P28223 2/20 0.45
HRH1 P35367 2/20 0.45
SIGMAR1 Q99720 3/20 0.41
SLC6A4 P31645 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MTNR1A P48039 3/20 0.36
MTNR1B P49286 3/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL9951252 0.89 MAOA (0.55) MAOAMAOBHTR2AHRH1SLC6A4
SCHEMBL1541274 0.89 MAOA (0.55) MAOAMAOBHTR2AHRH1SLC6A4
SCHEMBL385308 0.89 MAOA (0.55) MAOAMAOBHTR2AHRH1SLC6A4
SCHEMBL13681434 0.79 HTR2A (0.42) MAOAMAOBHTR2AHRH1SIGMAR1
SCHEMBL14223692 0.79 MAOA (0.50) MAOAMAOBMTNR1AMTNR1BALDH1A1
SCHEMBL3587290 0.78 MAOA (0.53) MAOAMAOBHTR2AHRH1MTNR1A
SCHEMBL2952008 0.78 MAOA (0.58) MAOAMAOBHTR2AHRH1SLC6A4
SCHEMBL1540363 0.78 MAOA (0.54) MAOAMAOBHTR2AHRH1SLC6A4
SCHEMBL1540197 0.78 MAOA (0.50) MAOAMAOBHTR2AHRH1SLC6A4
SCHEMBL1539939 0.77 MAOA (0.49) MAOAMAOBHTR2AHRH1SLC6A4

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
EP-1765778-B1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2012-01-25 EP disclosed
US-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES 2010-02-11 US disclosed
US-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES 2010-02-11 US disclosed
US-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES 2010-02-11 US disclosed
US-7585858-B2 N-sulfonylcarboximidamide apoptosis promoters ABBOTT LABORATORIES (US) 2009-09-08 US disclosed
US-20050272744-A1 N-sulfonylcarboximidamide apoptosis promoters ABBVIE INC. 2005-12-08 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-20100035879-A1 N-SULFONYLCARBOXIMIDAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BAD MAOA 3729/4885MAOB 3196/4885HTR2A 2426/4885
US-20050272744-A1 N-sulfonylcarboximidamide apoptosis promoters BAX, BCL2, BAD MAOA 3729/4885MAOB 3196/4885HTR2A 2426/4885

“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.