SCHEMBL3370667

SCHEMBL3370667

CCNC(=O)c1sccc1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.60
KMT2A Q03164 2/20 0.57
NPC1 O15118 6/20 0.55
RAB9A P51151 6/20 0.55
GAA P10253 3/20 0.55
ALDH1A1 P00352 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
GSK3B P49841 1/20 0.53
PPARG P37231 1/20 0.53
NCOR2 Q9Y618 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.51
HPGD P15428 2/20 0.51
NAMPT P43490 1/20 0.51
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
NFKB1 P19838 1/20 0.50
STAT1 P42224 1/20 0.50

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
SCHEMBL6360579 0.86 NPC1 (0.59) PKMKMT2ANPC1RAB9AGAA
SCHEMBL28364538 0.82 KMT2A (0.55) PKMKMT2ANPC1RAB9AGAA
SCHEMBL7472113 0.82 KMT2A (0.55) PKMKMT2ANPC1RAB9AGAA
SCHEMBL13964532 0.81 PKM (0.45) PKMKMT2ANPC1RAB9AGAA
SCHEMBL2482673 0.81 GSK3B (0.56) PKMKMT2ANPC1RAB9AGAA
SCHEMBL13753327 0.80 POLB (0.46) PKMKMT2ANPC1RAB9AGAA
SCHEMBL8791459 0.80 HPGD (0.54) PKMKMT2ANPC1RAB9AGAA
SCHEMBL2199408 0.79 PKM (0.47) PKMKMT2ANPC1RAB9AGAA
SCHEMBL2186238 0.79 HPGD (0.61) PKMKMT2ANPC1RAB9AGAA
SCHEMBL7983727 0.79 GAA (0.67) PKMKMT2ANPC1RAB9AGAA

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-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-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US 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 PKM 1518/4885KMT2A 2098/4885NPC1 228/4885
US-20140024583-A1 ORGANIC COMPOUNDS SCD, SCD5, FADS2 PKM 1518/4885KMT2A 2098/4885NPC1 228/4885

“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.