SCHEMBL3512933

SCHEMBL3512933

Nc1cnc(CCOC2CCCCO2)cn1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
DHFR P00374 1/20 0.35
FEN1 P39748 8/20 0.34
ALOX5AP P20292 6/20 0.34
ICAM1 P05362 1/20 0.32
SELE P16581 1/20 0.32
CHEK1 O14757 1/20 0.32
MET P08581 2/20 0.30

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
SCHEMBL26641352 0.80 KDM4C (0.53) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL31607849 0.80 KDM4C (0.53) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL3511939 0.80 KDM4C (0.56) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL14875565 0.78 KDM4C (0.57) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL4067951 0.77 KDM4C (0.59) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL3511707 0.77 NPC1 (0.53) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL3514416 0.77 KDM4C (0.53) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL28935874 0.74 KDM4C (0.65) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL2633488 0.72 KDM4C (0.56) KDM4CL3MBTL1NPC1RAB9AMEN1
SCHEMBL29447734 0.72 KDM4C (0.53) KDM4CL3MBTL1NPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130102617-A1 METHOD OF TREATING DIABETES, METABOLIC SYNDROME AND OBESITY USING PHENYLACETAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2013-04-25 US disclosed
US-20130102617-A1 METHOD OF TREATING DIABETES, METABOLIC SYNDROME AND OBESITY USING PHENYLACETAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2013-04-25 US disclosed
US-20130102617-A1 METHOD OF TREATING DIABETES, METABOLIC SYNDROME AND OBESITY USING PHENYLACETAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2013-04-25 US disclosed
US-8329707-B2 Substituted pyrazine compounds ASTELLAS PHARMA INC. (JP) 2012-12-11 US disclosed
US-8329707-B2 Substituted pyrazine compounds ASTELLAS PHARMA INC. (JP) 2012-12-11 US disclosed
US-8329707-B2 Substituted pyrazine compounds ASTELLAS PHARMA INC. (JP) 2012-12-11 US disclosed
US-20100286171-A1 PHENYLACETAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-11-11 US disclosed
US-20100286171-A1 PHENYLACETAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-11-11 US disclosed
EP-2236498-A1 PHENYL ACETAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2010-10-06 EP disclosed
EP-2236498-A1 PHENYL ACETAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2010-10-06 EP 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-20100286171-A1 PHENYLACETAMIDE DERIVATIVE AADAC, PGC, PC KDM4C 961/4885L3MBTL1 4317/4885NPC1 1244/4885
US-20130102617-A1 METHOD OF TREATING DIABETES, METABOLIC SYNDROME AND OBESITY USING PHENYLACETAMIDE DERIVATIVE PC, PCK2, GCKR KDM4C 2471/4885L3MBTL1 4654/4885NPC1 2338/4885

“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.