SCHEMBL442223

SCHEMBL442223

O=C(O)c1ccccc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
TP53 P04637 1/20 0.58
TSHR P16473 1/20 0.58
CASP1 P29466 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
PTGER1 P34995 1/20 0.54
HSP90AA1 P07900 1/20 0.53
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
KMT2A Q03164 1/20 0.51
FOLH1 Q04609 1/20 0.50
MRGPRX4 Q96LA9 1/20 0.50
SRD5A2 P31213 1/20 0.49
RECQL P46063 1/20 0.47
NR4A1 P22736 1/20 0.47
AKR1C4 P17516 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
Hydrochloric Acid SCHEMBL9812925 0.89 FOLH1 (0.57) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL16041577 0.87 PTGER1 (0.62) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL7802742 0.86 ALDH1A1 (0.63) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL15918927 0.86 PTGER1 (0.54) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL17785974 0.85 ALDH1A1 (0.53) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL5443146 0.84 LMNA (0.51) ALDH1A1PTGER1HSP90AA1LMNAGAA
SCHEMBL3672928 0.84 KDM4E (0.52) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL1712775 0.84 MYC (0.54) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL24043882 0.83 CES2 (0.53) ALDH1A1TP53TSHRCASP1SMN1; SMN2
SCHEMBL11815799 0.83 SMN1; SMN2 (0.67) ALDH1A1TP53TSHRCASP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES GERO PTE. LTD. (SG) 2023-02-16 US disclosed
EP-2325651-B1 Compositions and methods for stabilizing transthyretin and inhibiting transthyretin misfolding SCRIPPS RESEARCH INST (US) 2014-10-08 EP disclosed
US-20140134753-A1 METHODS FOR TREATING TRANSTHYRETIN AMYLOID DISEASES THE SCRIPPS RESEARCH INSTITUTE (US) 2014-05-15 US disclosed
US-8653119-B2 Methods for treating transthyretin amyloid diseases THE SCRIPPS RESEARCH INSTITUTE (US) 2014-02-18 US disclosed
US-8168663-B2 Pharmaceutically acceptable salt of 6-carboxy-2-(3,5 dichlorophenyl)-benzoxazole, and a pharmaceutical composition comprising the salt thereof THE SCRIPPS RESEARCH INSTITUTE (US) 2012-05-01 US disclosed
US-20120065237-A1 METHODS FOR TREATING TRANSTHYRETIN AMYLOID DISEASES THE SCRIPPS RESEARCH INSTITUTE (US) 2012-03-15 US disclosed
EP-1988397-B1 COMPOSITIONS AND USES FOR STABILISING TRANSTHYRETIN AND INHIBITING TRANSTHYRETIN MISFOLDING SCRIPPS RESEARCH INST (US) 2011-09-14 EP disclosed
EP-2325651-A2 Compositions and methods for stabilizing transthyretin and inhibiting transthyretin misfolding THE SCRIPPS RESEARCH INSTITUTE (US) 2011-05-25 EP disclosed
US-7727990-B2 Melanocortin receptor-specific piperazine and keto-piperazine compounds PALATIN TECHNOLOGIES, INC. (US) 2010-06-01 US disclosed
US-20100120919-A1 METHODS FOR TREATING TRANSTHYRETIN AMYLOID DISEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-05-13 US disclosed
EP-1587821-A4 COMPOSITIONS AND METHODS FOR STABILIZING TRANSTHYRETIN AND INHIBITING TRANSTHYRETIN MISFOLDING SCRIPPS RESEARCH INST (US) 2007-05-09 EP disclosed
US-7214695-B2 Compositions and methods for stabilizing transthyretin and inhibiting transthyretin misfolding THE SCRIPPS RESEARCH INSTITUTE (US) 2007-05-08 US disclosed
US-7214696-B2 Compositions and methods for stabilizing transthyretin and inhibiting transthyretin misfolding THE SCRIPPS RESEARCH INSTITUTE (US) 2007-05-08 US disclosed
US-20070078186-A1 Methods for treating transthyretin amyloid diseases THE SCRIPPS RESEARCH INSTITUTE 2007-04-05 US disclosed
WO-2007021991-A2 MELANOCORTIN RECEPTOR-SPECIFIC PIPERAZINE AND KETO-PIPERAZINE COMPOUNDS PALATIN TECHNOLOGIES, INC. (US) 2007-02-22 WO disclosed
US-20060287332-A1 Melanocortin Receptor-Specific Piperazine and Keto-Piperazine Compounds PALATIN TECHNOLOGIES, INC. (US) 2006-12-21 US disclosed
US-20060057644-A1 Compositions and methods for stabilizing transthyretin and inhibiting transthyretin misfolding SCRIPPS RESEARCH INSTITUTE, THE 2006-03-16 US disclosed
EP-1587821-A2 COMPOSITIONS AND METHODS FOR STABILIZING TRANSTHYRETIN AND INHIBITING TRANSTHYRETIN MISFOLDING The Scripps Research Institute (US) 2005-10-26 EP disclosed
US-20040152140-A1 Compositions and methods for stabilizing transthyretin and inhibiting transthyretin misfolding THE SCRIPPS RESEARCH INSTITUTE 2004-08-05 US disclosed
WO-2004056315-A2 COMPOSITIONS AND METHODS FOR STABILIZING TRANSTHYRETIN AND INHIBITING TRANSTHYRETIN MISFOLDING THE SCRIPPS RESEARCH INSTITUTE (US) 2004-07-08 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 (6 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-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES PFKFB3, PFKFB4, PFKFB1 ALDH1A1 1943/4885TP53 2372/4885TSHR 4576/4885
US-20070078186-A1 Methods for treating transthyretin amyloid diseases TTR, TTPA, PRNP ALDH1A1 2744/4885TP53 712/4885TSHR 1892/4885
US-20120065237-A1 METHODS FOR TREATING TRANSTHYRETIN AMYLOID DISEASES TTR, TTPA, PRNP ALDH1A1 2744/4885TP53 712/4885TSHR 1892/4885
US-20060287332-A1 Melanocortin Receptor-Specific Piperazine and Keto-Piperazine Compounds MC4R, MC5R, MC1R ALDH1A1 3080/4885TP53 4639/4885TSHR 74/4885
US-20100120919-A1 METHODS FOR TREATING TRANSTHYRETIN AMYLOID DISEASES TTR, TTPA, PRNP ALDH1A1 2744/4885TP53 712/4885TSHR 1892/4885
US-20060057644-A1 Compositions and methods for stabilizing transthyretin and inhibiting transthyretin misfolding TTR, TTPA, PRNP ALDH1A1 3491/4885TP53 268/4885TSHR 2212/4885

“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.