SCHEMBL3180328

SCHEMBL3180328

CC(=O)c1c(NS(=O)(=O)c2ccc(C)cc2)cc(C)nc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.52
▸ LMNA P02545 3/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ TSHR P16473 1/20 0.50
▸ HPGD P15428 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ GAA P10253 2/20 0.48
▸ GFER P55789 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ PKM P14618 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ CASP6 P55212 1/20 0.47
▸ CTDSP1 Q9GZU7 1/20 0.47

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
SCHEMBL3177473 0.84 LMNA (0.58) ALDH1A1LMNASMN1; SMN2TSHRHPGD
SCHEMBL12903578 0.71 SMN1; SMN2 (0.76) ALDH1A1LMNASMN1; SMN2TSHRMAPT
SCHEMBL3263302 0.71 LMNA (0.54) ALDH1A1LMNASMN1; SMN2TSHRHPGD
SCHEMBL5181886 0.70 HSD17B2 (0.78) ALDH1A1LMNAMAPTGAAGFER
SCHEMBL7595414 0.69 ALDH1A1 (0.70) ALDH1A1LMNAMAPTGAAGFER
SCHEMBL2367869 0.69 ALDH1A1 (0.60) ALDH1A1LMNASMN1; SMN2MAPTGAA
SCHEMBL6302115 0.69 LMNA (0.62) ALDH1A1LMNASMN1; SMN2TSHRMAPT
SCHEMBL7284695 0.69 TDP1 (0.51) ALDH1A1LMNAGAAGFERMEN1
SCHEMBL7571483 0.68 LMNA (0.67) ALDH1A1LMNASMN1; SMN2TSHRMAPT
SCHEMBL6302086 0.68 HSD17B2 (0.65) ALDH1A1LMNAMAPTGAAGFER

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 7 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
US-20100010035-A1 Novel Dual Action Receptors Antagonists (Dara) at the Ati and Eta Receptors TORRENT PHARMACEUTICALS LTD. (IN) 2010-01-14 — — US disclosed
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
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 892/4885LMNA 2967/4885SMN1; SMN2 4868/4885

“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.

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