SCHEMBL3371072

SCHEMBL3371072

Cc1ccsc1C(=O)NCc1cccc(F)c1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.55
KMT2A Q03164 1/20 0.54
MAPK1 P28482 1/20 0.53
RAB9A P51151 1/20 0.53
ADORA2A P29274 1/20 0.53
ADORA2B P29275 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.50
SCD O00767 2/20 0.49
EPHX2 P34913 1/20 0.49
SENP1 Q9P0U3 1/20 0.49
THRB P10828 2/20 0.48
ALDH1A1 P00352 2/20 0.48
LMNA P02545 2/20 0.47
HPGD P15428 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL3369612 0.83 KMT2A (0.56) CHRM4KMT2AMAPK1ALDH1A1LMNA
SCHEMBL3049318 0.83 KMT2A (0.66) KMT2AMAPK1RAB9AL3MBTL1ALDH1A1
SCHEMBL3369239 0.80 CHRM4 (0.56) CHRM4MAPK1RAB9ASCDEPHX2
SCHEMBL15421497 0.76 NAMPT (0.62) KMT2ARAB9AALDH1A1LMNAHPGD
SCHEMBL20804355 0.75 HPGD (0.57) KMT2AMAPK1RAB9AALDH1A1HPGD
SCHEMBL10194841 0.75 MMP13 (0.61) KMT2AALDH1A1LMNA
SCHEMBL13082534 0.75 CHRM4 (0.62) CHRM4KMT2ARAB9AADORA2AADORA2B
SCHEMBL2009061 0.75 SLC6A9 (0.63) KMT2ARAB9AL3MBTL1
SCHEMBL3109722 0.75 SRC (0.61) MAPK1RAB9AEPHX2ALDH1A1
SCHEMBL29699631 0.75 SRC (0.61) MAPK1RAB9AEPHX2ALDH1A1

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-20140024583-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2014-01-23 US disclosed
US-8501746-B2 Organic compounds XENON PHARMACEUTICALS INC. (CA) 2013-08-06 US disclosed
WO-2007143597-A9 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-11 WO disclosed
EP-2029572-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-03 EP disclosed
US-20090156615-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-06-18 US disclosed
EP-2029572-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2009-03-04 EP disclosed
WO-2007143597-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-12-13 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 (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-20090156615-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 CHRM4 3011/4885KMT2A 2098/4885MAPK1 4752/4885
US-20140024583-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 CHRM4 3011/4885KMT2A 2098/4885MAPK1 4752/4885

“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.