SCHEMBL349655

SCHEMBL349655

CCCCOC(=O)NC(CC(N)=S)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.52
SMN1; SMN2 Q16637 7/20 0.49
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.45
GPR88 Q9GZN0 2/20 0.45
CTSK P43235 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
TSHR P16473 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
SCHEMBL14040614 0.87 SMN1; SMN2 (0.57) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL844472 0.87 SMN1; SMN2 (0.57) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL4385673 0.85 SMN1; SMN2 (0.51) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL27648565 0.85 SMN1; SMN2 (0.51) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL9848391 0.84 SMN1; SMN2 (0.53) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL9848476 0.84 SMN1; SMN2 (0.53) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8121337 0.81 SMN1; SMN2 (0.52) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL4651068 0.81 FAAH (0.47) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8382243 0.80 FAAH (0.46) FAAHSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL3630691 0.80 SMN1; SMN2 (0.51) FAAHSMN1; SMN2NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8361968-B2 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-01-29 US disclosed
US-20120015868-A1 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-19 US disclosed
US-20090318365-A1 METASTIN DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-12-24 US disclosed
EP-2113513-A2 Metastin derivatives and use thereof Takeda Pharmaceutical Company Limited (JP) 2009-11-04 EP disclosed
EP-1758932-A2 METASTIN DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-03-07 EP disclosed
US-20060241051-A1 Metastin derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-10-26 US disclosed
WO-2006001499-A2 METASTIN DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-05 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 (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-20120015868-A1 Metastin derivatives and use thereof MET, HGFAC, HGF FAAH 3818/4885SMN1; SMN2 2477/4885NPC1 2592/4885
US-20090318365-A1 METASTIN DERIVATIVES AND USE THEREOF MET, HGF, HGFAC FAAH 3861/4885SMN1; SMN2 2629/4885NPC1 2676/4885
US-20060241051-A1 Metastin derivatives and use thereof MET, HGFAC, HGF FAAH 3818/4885SMN1; SMN2 2477/4885NPC1 2592/4885

“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.