SCHEMBL10309751

SCHEMBL10309751

Cc1cccc(CSc2nc(N)c3nc(O)n(Cc4ccccc4)c3n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 2/20 0.45
POLB P06746 2/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
GAA P10253 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
PKM P14618 1/20 0.41
TP53 P04637 2/20 0.41
TLR7 Q9NYK1 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL10309752 0.89 RAB9A (0.45) ALDH1A1HPGDSMN1; SMN2LMNAPOLB
SCHEMBL7208339 0.89 ADORA3 (0.48) ALDH1A1SMN1; SMN2LMNAPOLBTSHR
SCHEMBL7205483 0.88 TOP2A (0.45) ALDH1A1HPGDSMN1; SMN2LMNAMAPT
SCHEMBL7205773 0.87 TLR7 (0.48) ALDH1A1POLBMAPTPTGDR2TDP1
SCHEMBL2060205 0.86 ADORA3 (0.40) ALDH1A1HPGDSMN1; SMN2LMNAPOLB
SCHEMBL2060430 0.86 SMN1; SMN2 (0.52) ALDH1A1HPGDSMN1; SMN2LMNAPOLB
SCHEMBL7210357 0.84 DRD2 (0.46) ALDH1A1SMN1; SMN2MAPTADORA3NPC1
SCHEMBL2060384 0.84 TLR7 (0.43) ALDH1A1SMN1; SMN2MAPTTSHRGAA
SCHEMBL2060176 0.84 DRD2 (0.51) ALDH1A1HPGDSMN1; SMN2LMNAPOLB
SCHEMBL7209553 0.83 TSHR (0.44) ALDH1A1HPGDPOLBMAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178743-A1 NOVEL ADENINE COMPOUND AND USE THEREOF DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-07-12 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-20120178743-A1 NOVEL ADENINE COMPOUND AND USE THEREOF ADORA1, HRH4, P2RY10 ALDH1A1 875/4885HPGD 449/4885SMN1; SMN2 4605/4885

“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.