SCHEMBL4204580

SCHEMBL4204580

COc1ccc(NS(=O)(=O)c2ccc(Br)s2)c2c1C[C@@H](N(C)C)CO2

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.53
POLB P06746 2/20 0.53
LMNA P02545 6/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
TSHR P16473 2/20 0.50
ALDH1A1 P00352 1/20 0.50
HTT P42858 3/20 0.47
GHSR Q92847 1/20 0.46
HTR6 P50406 1/20 0.40
QRFPR Q96P65 1/20 0.40
THRB P10828 2/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
PKM P14618 1/20 0.39
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HTR7 P34969 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
SCHEMBL4209408 0.89 SMN1; SMN2 (0.47) MAPK1POLBLMNASMN1; SMN2ALDH1A1
SCHEMBL4208341 0.87 HTR6 (0.41) MAPK1POLBLMNASMN1; SMN2TSHR
SCHEMBL4209991 0.85 HTR6 (0.38) MAPK1POLBLMNASMN1; SMN2TSHR
SCHEMBL4215742 0.85 HTR6 (0.44) MAPK1POLBLMNASMN1; SMN2TSHR
SCHEMBL4200928 0.83 SMN1; SMN2 (0.52) POLBSMN1; SMN2ALDH1A1HTR6QRFPR
SCHEMBL4205717 0.83 GHSR (0.43) LMNATSHRALDH1A1HTTGHSR
SCHEMBL4207725 0.83 TP53 (0.41) MAPK1POLBGHSRHTR6QRFPR
SCHEMBL4201683 0.83 HTR6 (0.45) MAPK1POLBSMN1; SMN2TSHRALDH1A1
SCHEMBL4196128 0.82 HTR6 (0.55) MAPK1POLBLMNASMN1; SMN2TSHR
SCHEMBL4204582 0.82 TP53 (0.45) MAPK1POLBLMNAGHSRHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090030038-A1 Novel 8-Sulfonylamino-3 Aminosubstituted Chroman or Tetrahydronaphtalene Derivatives Modulating the 5Ht6 Receptor ASTRAZENECA AB (SE) 2009-01-29 US claimed
US-20090030038-A1 Novel 8-Sulfonylamino-3 Aminosubstituted Chroman or Tetrahydronaphtalene Derivatives Modulating the 5Ht6 Receptor ASTRAZENECA AB (SE) 2009-01-29 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 (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-20090030038-A1 Novel 8-Sulfonylamino-3 Aminosubstituted Chroman or Tetrahydronaphtalene Derivatives Modulating the 5Ht6 Receptor HTR6, HTR1A, HTR1D MAPK1 3098/4885POLB 4768/4885LMNA 1549/4885

“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.