SCHEMBL2915740

SCHEMBL2915740

CCCCCc1ccc(NC(=S)NC(=O)c2cc3c(N(C)C)nccc3o2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 6/20 0.49
SIRT1 Q96EB6 6/20 0.49
MAPT P10636 3/20 0.44
SPHK1 Q9NYA1 4/20 0.41
ALDH1A1 P00352 4/20 0.40
GAA P10253 2/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HPGD P15428 1/20 0.40
LMNA P02545 2/20 0.40
NPC1 O15118 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL2915403 0.89 PTGES (0.47) SIRT2SIRT1MAPTALDH1A1TP53
SCHEMBL14018574 0.87 SIRT2 (0.46) SIRT2SIRT1MAPTSPHK1ALDH1A1
SCHEMBL2915461 0.86 SIRT2 (0.45) SIRT2SIRT1MAPTALDH1A1GAA
SCHEMBL2914827 0.84 S1PR4 (0.43) MAPTALDH1A1HTTMEN1KMT2A
SCHEMBL13175624 0.79 ALDH1A1 (0.54) SIRT2SIRT1MAPTALDH1A1HTT
SCHEMBL2869478 0.79 SIRT2 (0.53) SIRT2SIRT1MAPTALDH1A1HTT
SCHEMBL2917242 0.79 ALDH1A1 (0.53) SIRT2SIRT1MAPTALDH1A1HTT
SCHEMBL2914457 0.79 ALDH1A1 (0.53) SIRT2SIRT1MAPTALDH1A1HTT
SCHEMBL14137239 0.78 MAPT (0.49) MAPTALDH1A1TP53HTTMEN1
SCHEMBL13175950 0.77 ALDH1A1 (0.54) SIRT2SIRT1MAPTALDH1A1HTT

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
EP-1709047-B1 AZABENZOFURAN SUBSTITUTED THIOUREAS AS INHIBITORS OF VIRAL REPLICATION ACHILLION PHARMACEUTICALS INC (US) 2010-09-01 EP claimed
US-7439374-B2 Azabenzofuran substituted thioureas; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2008-10-21 US claimed
US-20050228013-A1 Azabenzofuran substituted thioureas; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. 2005-10-13 US claimed
EP-1709047-B1 AZABENZOFURAN SUBSTITUTED THIOUREAS AS INHIBITORS OF VIRAL REPLICATION ACHILLION PHARMACEUTICALS INC (US) 2010-09-01 EP disclosed
EP-1709047-B1 AZABENZOFURAN SUBSTITUTED THIOUREAS AS INHIBITORS OF VIRAL REPLICATION ACHILLION PHARMACEUTICALS INC (US) 2010-09-01 EP disclosed
US-7439374-B2 Azabenzofuran substituted thioureas; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2008-10-21 US disclosed
US-7439374-B2 Azabenzofuran substituted thioureas; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2008-10-21 US disclosed
US-7439374-B2 Azabenzofuran substituted thioureas; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. (US) 2008-10-21 US disclosed
US-20050228013-A1 Azabenzofuran substituted thioureas; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. 2005-10-13 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 (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-20050228013-A1 Azabenzofuran substituted thioureas; inhibitors of viral replication NAT1, PIGS, ADORA1 SIRT2 896/4885SIRT1 503/4885MAPT 4359/4885

“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.