SCHEMBL4369727

SCHEMBL4369727

CCOC(=O)Cc1ccc(NC(=S)NC(=O)COc2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.72
ALDH1A1 P00352 10/20 0.72
SMN1; SMN2 Q16637 4/20 0.72
HPGD P15428 4/20 0.72
HTT P42858 2/20 0.72
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
RAB9A P51151 3/20 0.55
POLB P06746 2/20 0.53
LMNA P02545 2/20 0.53
NPC1 O15118 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
TDP1 Q9NUW8 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
THRB P10828 1/20 0.51
APOBEC3G Q9HC16 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALOX12 P18054 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL4363304 0.84 MAPT (1.00) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL14096016 0.83 MAPT (0.74) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL14096026 0.82 ALDH1A1 (0.69) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL14096030 0.82 MAPT (0.69) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL4365290 0.82 MAPT (0.69) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL14096049 0.82 MAPT (0.69) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL14096020 0.82 ALDH1A1 (0.75) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL4362186 0.81 MAPT (0.67) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL5450484 0.81 MAPT (0.74) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL4369676 0.80 MAPT (0.73) MAPTALDH1A1SMN1; SMN2HPGDHTT

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 11 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-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 US disclosed
US-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv ACHILLION PHARMACEUTICALS, INC. (US) 2008-08-28 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 (3 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 MAPT 3454/4885ALDH1A1 310/4885SMN1; SMN2 2545/4885
US-20080207760-A1 Pharmaceutical Compositions For and Methods of Inhibiting Hcv RNASE1, SARS1, EIF2AK2 MAPT 4038/4885ALDH1A1 2930/4885SMN1; SMN2 4344/4885
US-20060014836-A1 Substituted aryl thioureas and related compounds; inhibitors of viral replication NAT1, PIGS, SLC10A1 MAPT 3752/4885ALDH1A1 221/4885SMN1; SMN2 2335/4885

“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.