SCHEMBL4359859

SCHEMBL4359859

CCCCOC(=O)c1ccc(NC(=S)NC(=O)COC)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.67
ALDH1A1 P00352 7/20 0.63
GAA P10253 3/20 0.63
KMT2A Q03164 3/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
RECQL P46063 1/20 0.61
RNASEL Q05823 2/20 0.58
MAPT P10636 7/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
RAB9A P51151 2/20 0.57
HTT P42858 2/20 0.57
NPC1 O15118 1/20 0.56
CASP1 P29466 1/20 0.56
MEN1 O00255 1/20 0.54
MAPK1 P28482 2/20 0.53
POLB P06746 1/20 0.53

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
SCHEMBL5838459 0.91 ALDH1A1 (0.56) HPGDALDH1A1GAAKMT2AL3MBTL1
SCHEMBL13956730 0.89 HPGD (0.63) HPGDALDH1A1GAAKMT2AL3MBTL1
SCHEMBL14095962 0.89 RNASEL (0.67) HPGDALDH1A1GAAKMT2ARECQL
SCHEMBL14095954 0.88 HPGD (0.66) HPGDALDH1A1GAAKMT2ARECQL
SCHEMBL4375509 0.88 MAPT (0.67) HPGDALDH1A1GAAKMT2ARECQL
SCHEMBL4362279 0.85 MAPT (0.70) HPGDALDH1A1GAAKMT2ARECQL
SCHEMBL4372355 0.85 MAPT (0.80) HPGDALDH1A1GAAKMT2ARECQL
SCHEMBL4361509 0.85 HPGD (0.75) HPGDALDH1A1GAAKMT2ARECQL
SCHEMBL4366287 0.85 MAPT (0.64) HPGDALDH1A1GAAKMT2AL3MBTL1
SCHEMBL14096046 0.85 ALDH1A1 (0.66) HPGDALDH1A1GAAKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060014836-A1 Substituted aryl thioureas and related compounds; inhibitors of viral replication CHEN DAWEI 2006-01-19 US claimed
EP-1562895-A1 SUBSTITUTED ARYL ACYLTHIOUREAS AND RELATED COMPOUNDS; INHIBITORS OF VIRAL REPLICATION Achillion Pharmaceuticals, Inc. (US) 2005-08-17 EP claimed
US-20040138205-A1 Substituted aryl thioureas and related compounds; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. 2004-07-15 US claimed
WO-2004046095-A1 SUBSTITUTED ARYL THIOUREAS AND RELATED COMPOUNDS; INHIBITORS OF VIRAL REPLICATION ACHILLION PHARMACEUTICALS, INC. (US) 2004-06-03 WO claimed
US-7476686-B2 Substituted aryl thioureas and related compounds; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2009-01-13 US disclosed
US-7476686-B2 Substituted aryl thioureas and related compounds; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2009-01-13 US disclosed
US-7476686-B2 Substituted aryl thioureas and related compounds; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2009-01-13 US disclosed
US-7094807-B2 Substituted aryl thioureas and related compounds; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2006-08-22 US disclosed
US-20060014836-A1 Substituted aryl thioureas and related compounds; inhibitors of viral replication CHEN DAWEI 2006-01-19 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 (2 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-20040138205-A1 Substituted aryl thioureas and related compounds; inhibitors of viral replication NAT1, PIGS, TPMT HPGD 3824/4885ALDH1A1 310/4885GAA 370/4885
US-20060014836-A1 Substituted aryl thioureas and related compounds; inhibitors of viral replication NAT1, PIGS, SLC10A1 HPGD 3743/4885ALDH1A1 221/4885GAA 407/4885

“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.