SCHEMBL3175779

SCHEMBL3175779

Cc1cc(S(=O)(=O)Cl)c(Br)s1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
TSHR P16473 2/20 0.37
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
TAAR1 Q96RJ0 1/20 0.34
HTT P42858 5/20 0.33
HPGD P15428 3/20 0.33
NPSR1 Q6W5P4 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 2/20 0.33
GFER P55789 1/20 0.32
LMNA P02545 2/20 0.32
TRPV4 Q9HBA0 1/20 0.32
MAPK1 P28482 1/20 0.32
MAPT P10636 2/20 0.31
KDM4E B2RXH2 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
SCHEMBL3179215 0.79 ALDH1A1 (0.37) ALDH1A1TSHRCYP2C9CYP2C19RECQL
SCHEMBL3004459 0.78
SCHEMBL392578 0.78 ALDH1A1 (0.52) ALDH1A1TSHRCYP2C9CYP2C19RECQL
SCHEMBL2977321 0.71 ALDH1A1 (0.33) ALDH1A1TSHRCYP2C9CYP2C19RECQL
SCHEMBL4606362 0.71 ALDH1A1 (0.43) ALDH1A1TSHRHPGDGFERLMNA
SCHEMBL6964654 0.71 DAO (0.41) ALDH1A1SMN1; SMN2LMNAMAPTKDM4E
SCHEMBL6964660 0.67
SCHEMBL4534390 0.67 GAA (0.31) GAALMNAMAPT
SCHEMBL8285092 0.66
SCHEMBL22508643 0.65 ALDH1A1 (0.41) ALDH1A1TSHRHTTHPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100010035-A1 Novel Dual Action Receptors Antagonists (Dara) at the Ati and Eta Receptors TORRENT PHARMACEUTICALS LTD. (IN) 2010-01-14 US disclosed
CN-101437818-A Novel Dual Acting Receptor Antagonists (DARA) for AT1 and ETA receptors TORRENT PHARMACEUTICALS LTD (IN) 2009-05-20 CN disclosed
EP-1996588-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS Torrent Pharmaceuticals Ltd (IN) 2008-12-03 EP disclosed
WO-2007100295-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS TORRENT PHARMACEUTICALS LTD (IN) 2007-09-07 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-20100010035-A1 Novel Dual Action Receptors Antagonists (Dara) at the Ati and Eta Receptors EDNRA, EDNRB, AGTR1 ALDH1A1 892/4885TSHR 156/4885CYP2C9 2139/4885

“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.