SCHEMBL13801152

SCHEMBL13801152

c1ccc(-c2nnc(-c3nc4sc(-c5nnc(-c6ccccc6)o5)nc4s3)o2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 15/20 0.63
RAB9A P51151 15/20 0.63
SMN1; SMN2 Q16637 9/20 0.63
ATAD2 Q6PL18 1/20 0.53
HPGD P15428 7/20 0.52
NFKB1 P19838 2/20 0.52
NFKB2 Q00653 2/20 0.52
RELA Q04206 2/20 0.52
POLB P06746 2/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 6/20 0.50
KDM4E B2RXH2 5/20 0.50
HSD17B10 Q99714 2/20 0.50
GLA P06280 1/20 0.50
MAPT P10636 1/20 0.50
ALOX15 P16050 1/20 0.50
NOTUM Q6P988 2/20 0.48
TSHR P16473 4/20 0.47
TP53 P04637 2/20 0.47

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
SCHEMBL13801154 0.91 NPC1 (0.61) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL46426 0.79 NPC1 (1.00) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL4343181 0.77 NPC1 (0.94) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL9312637 0.75 ADORA3 (0.53) SMN1; SMN2HPGDPOLBMEN1KMT2A
SCHEMBL74999 0.75 NPC1 (0.90) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL46424 0.75 NPC1 (0.90) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL22858502 0.75 NPC1 (0.90) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL522555 0.75 NPC1 (0.90) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL8044447 0.75 NPC1 (0.59) NPC1RAB9ASMN1; SMN2ATAD2HPGD
SCHEMBL1105099 0.73 NPC1 (0.85) NPC1RAB9ASMN1; SMN2ATAD2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT TOYO INK MFG. CO., LTD. (JP) 2009-06-18 US disclosed
US-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT TOYO INK MFG. CO., LTD. (JP) 2009-06-18 US 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-20090156827-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS AND ORGANIC ELECTROLUMINESCENT ELEMENT ELP1, ELAVL1, ELF3 NPC1 2208/4885RAB9A 2849/4885SMN1; SMN2 546/4885

“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.