SCHEMBL2363775

SCHEMBL2363775

CCCCCNc1ccc2c(c1)nnn2-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
NPC1 O15118 2/20 0.50
KDM4E B2RXH2 2/20 0.50
SOAT2 O75908 2/20 0.47
SOAT1 P35610 2/20 0.47
CYP4Z1 Q86W10 5/20 0.43
DHODH Q02127 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.41
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KCNH3 Q9ULD8 1/20 0.40
ASAH1 Q13510 1/20 0.39
ABL1 P00519 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL1356753 0.78 FGFR1 (0.62) NPC1KDM4EALDH1A1HPGDRAB9A
SCHEMBL2364027 0.72 DHODH (0.42) SOAT2SOAT1DHODHKCNH3ABL1
SCHEMBL3807006 0.70 NPC1 (0.66) L3MBTL1NPC1KDM4EDHODHALDH1A1
SCHEMBL19911612 0.70 NPC1 (0.66) L3MBTL1NPC1KDM4EDHODHALDH1A1
SCHEMBL9505827 0.70 NPC1 (0.66) L3MBTL1NPC1KDM4EDHODHALDH1A1
SCHEMBL18167005 0.70 KDM4E (0.66) L3MBTL1NPC1KDM4EDHODHALDH1A1
SCHEMBL19848194 0.70 NPC1 (0.60) L3MBTL1NPC1KDM4EALDH1A1HPGD
SCHEMBL13305031 0.68 GAA (0.61) L3MBTL1NPC1KDM4EDHODHALDH1A1
SCHEMBL2364108 0.68 KDM4E (0.65) NPC1KDM4EALDH1A1HPGDRAB9A
SCHEMBL19911581 0.68 NPC1 (1.00) L3MBTL1NPC1KDM4EDHODHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012217-B2 Benzimidazole compounds differentiate a mammalian stem cell into mesodermal or cardiomyocyte cells BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2015-04-21 US disclosed
EP-2348855-A2 SMALL MOLECULE COMPOUNDS FOR STEM CELL DIFFERENTIATION Burnham Institute for Medical Research (US) 2011-08-03 EP disclosed
US-20100159596-A1 SMALL MOLECULE COMPOUNDS FOR STEM CELL DIFFERENTIATION BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-06-24 US disclosed
WO-2010033643-A2 SMALL MOLECULE COMPOUNDS FOR STEM CELL DIFFERENTIATION BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-03-25 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 (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-20100159596-A1 SMALL MOLECULE COMPOUNDS FOR STEM CELL DIFFERENTIATION RCOR3, BRD3, BRPF3 L3MBTL1 328/4885NPC1 1400/4885KDM4E 2848/4885

“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.