SCHEMBL569213

SCHEMBL569213

COCCn1c(SC)nc2cccnc21

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.59
MAPT P10636 1/20 0.57
ALDH1A1 P00352 4/20 0.54
TDP1 Q9NUW8 2/20 0.53
POLB P06746 2/20 0.53
ALOX15 P16050 1/20 0.52
TP53 P04637 1/20 0.47
LMNA P02545 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 1/20 0.43
TSHR P16473 1/20 0.43
AR P10275 1/20 0.43
RAB9A P51151 2/20 0.42
USP2 O75604 1/20 0.42
PKM P14618 2/20 0.41
MAPK14 Q16539 1/20 0.41
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL24129458 0.78 HPGD (0.61) MAPTALDH1A1POLBTP53LMNA
SCHEMBL569209 0.77 NPSR1 (0.50) NPSR1MAPTALDH1A1TDP1POLB
SCHEMBL569319 0.76 RAB9A (0.45) NPSR1MAPTALDH1A1POLBTP53
SCHEMBL569037 0.76 RAB9A (0.57) MAPTALDH1A1TDP1POLBALOX15
SCHEMBL19771402 0.74 TP53 (0.56) MAPTPOLBTP53LMNA
SCHEMBL569045 0.73 ALDH1A1 (0.46) NPSR1MAPTALDH1A1TDP1POLB
SCHEMBL928943 0.73 CYP1A2 (0.71) ALDH1A1ALOX15LMNATSHRUSP2
SCHEMBL14936005 0.71 MAPK14 (0.39) NPSR1MAPTALDH1A1TDP1POLB
SCHEMBL17966781 0.70 ENPP2 (0.59) ALDH1A1POLBTP53LMNA
SCHEMBL928085 0.70 CYP1A2 (0.71) ALDH1A1ALOX15TP53LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2601192-B1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICALS CO (JP) 2017-03-01 EP disclosed
US-9029536-B2 Fused heterocyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-12 US disclosed
US-20130172292-A1 FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-07-04 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-20130172292-A1 FUSED HETEROCYCLIC COMPOUNDS PDE10A, PDE3A, PDE2A NPSR1 1090/4885MAPT 4109/4885ALDH1A1 270/4885

“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.