SCHEMBL1495969

SCHEMBL1495969

CCOC(=O)CCCN(c1ccccc1C(=O)OC)S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.45
LMNA P02545 3/20 0.44
KMT2A Q03164 4/20 0.43
ALDH1A1 P00352 2/20 0.43
PTGER1 P34995 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
RORC P51449 1/20 0.42
BMP1 P13497 1/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL1291299 0.86 PSEN1 (0.51) TP53MAPTL3MBTL1
SCHEMBL25333728 0.86 PSEN1 (0.43) TP53MAPTL3MBTL1KMT2ARORC
SCHEMBL26159161 0.86 PSEN1 (0.53) TP53MAPTL3MBTL1POLB
SCHEMBL23209700 0.86 MMP1 (0.46) TP53MAPTL3MBTL1LMNAALDH1A1
SCHEMBL7336907 0.85 HCRTR2 (0.43) TP53MAPTL3MBTL1LMNAKMT2A
SCHEMBL17158346 0.82 C5AR1 (0.44) TP53MAPTL3MBTL1KMT2AALDH1A1
SCHEMBL8653909 0.79 HCRTR2 (0.44) TP53MAPTL3MBTL1LMNAKMT2A
SCHEMBL16628510 0.78 PSEN1 (0.45) TP53MAPTLMNAKMT2ARORC
SCHEMBL344172 0.78 TP53 (0.44) TP53MAPTL3MBTL1LMNAKMT2A
SCHEMBL7814298 0.77 KEAP1 (0.52) TP53MAPTKMT2AALDH1A1BMP1

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159463-A1 BENZONITRIC HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI ZHONGZE THERAPEUTICS, CO. LTD. (CN) 2023-05-25 US disclosed
EP-1781661-B1 VASOPRESSIN V1A ANTAGONISTS VANTIA LTD (GB) 2017-06-07 EP disclosed
US-8999969-B2 Anti-RSV compounds GILEAD SCIENCES, INC. (US) 2015-04-07 US disclosed
US-8999969-B2 Anti-RSV compounds GILEAD SCIENCES, INC. (US) 2015-04-07 US disclosed
US-20120196846-A1 ANTI-RSV COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-08-02 US disclosed
US-20120196846-A1 ANTI-RSV COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-08-02 US disclosed
US-8202858-B2 Vasopressin V1a antagonists VANTIA LIMITED (GB) 2012-06-19 US disclosed
US-8202858-B2 Vasopressin V1a antagonists VANTIA LIMITED (GB) 2012-06-19 US disclosed
EP-2256119-B1 Vasopressin V1a antagonists VANTIA LTD (GB) 2012-05-09 EP disclosed
EP-2256119-B1 Vasopressin V1a antagonists VANTIA LTD (GB) 2012-05-09 EP disclosed
EP-1670768-B1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA LILLY CO ELI (US) 2009-09-09 EP disclosed
US-20090029965-A1 Vasopressin V1a Antagonists FERRING B.V. (NL) 2009-01-29 US disclosed
US-20090029965-A1 Vasopressin V1a Antagonists FERRING B.V. (NL) 2009-01-29 US disclosed
US-20070254869-A1 Compounds And Methods For Treating Dislipidemia ELI LILLY AND COMPANY (US) 2007-11-01 US disclosed
EP-1781661-A2 VASOPRESSIN V1A ANTAGONISTS Ferring B.V. (NL) 2007-05-09 EP disclosed
EP-1670768-A1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA ELI LILLY AND COMPANY (US) 2006-06-21 EP disclosed
EP-1632494-A1 Vasopressin v1a antagonists FERRING B.V. (NL) 2006-03-08 EP disclosed
WO-2006021213-A2 VASOPRESSIN V1A ANTAGONISTS FERRING B.V. (NL) 2006-03-02 WO disclosed
WO-2006021213-A2 VASOPRESSIN V1A ANTAGONISTS FERRING B.V. (NL) 2006-03-02 WO disclosed
WO-2005037796-A1 COMPOUNDS AND METHODS FOR TREATING DYSLIPIDEMIA ELI LILLY AND COMPANY (US) 2005-04-28 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 (4 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-20230159463-A1 BENZONITRIC HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF HDAC11, HDAC1, HDAC6 TP53 2137/4885MAPT 1867/4885L3MBTL1 2681/4885
US-20120196846-A1 ANTI-RSV COMPOUNDS SERPINB1, SERPINC1, SERPINA6 TP53 4353/4885MAPT 3368/4885L3MBTL1 3860/4885
US-20070254869-A1 Compounds And Methods For Treating Dislipidemia APOB, CETP, PCSK9 TP53 4780/4885MAPT 4605/4885L3MBTL1 849/4885
US-20090029965-A1 Vasopressin V1a Antagonists AVPR1A, AVPR2, AVPR1B TP53 4084/4885MAPT 4727/4885L3MBTL1 4368/4885

“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.