SCHEMBL2546606

SCHEMBL2546606

COc1ccc(CNc2ccc3[nH]cnc3c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.58
NPC1 O15118 5/20 0.58
RAB9A P51151 5/20 0.58
KDM4E B2RXH2 5/20 0.58
QPCT Q16769 2/20 0.57
L3MBTL1 Q9Y468 3/20 0.55
LMNA P02545 1/20 0.55
ALDH1A1 P00352 4/20 0.54
TP53 P04637 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HSD17B10 Q99714 1/20 0.54
MMP12 P39900 1/20 0.52
TDP1 Q9NUW8 2/20 0.52
HPGD P15428 2/20 0.52
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
GAA P10253 2/20 0.50
APAF1 O14727 1/20 0.49
POLB P06746 1/20 0.49
CASP3 P42574 1/20 0.49

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
SCHEMBL2541359 0.90 QPCT (0.69) MAPTNPC1RAB9AKDM4EQPCT
SCHEMBL22900298 0.86 MAPT (0.48) MAPTNPC1RAB9AKDM4EQPCT
SCHEMBL2538614 0.85 NPC1 (0.56) MAPTNPC1RAB9AKDM4EQPCT
SCHEMBL2540200 0.82 RAB9A (0.54) MAPTNPC1RAB9AKDM4EQPCT
SCHEMBL3633668 0.82 QPCT (0.84) QPCTLMNAALDH1A1KMT2AMEN1
SCHEMBL2538625 0.82 IP6K1 (0.63) MAPTRAB9AKDM4EQPCTLMNA
SCHEMBL24125161 0.82 PPARA (0.52) MAPTNPC1RAB9AQPCTL3MBTL1
SCHEMBL2543317 0.82 KMT2A (0.58) MAPTNPC1RAB9AKDM4EQPCT
SCHEMBL2545579 0.82 RAB9A (0.55) MAPTNPC1RAB9AKDM4EQPCT
SCHEMBL21303664 0.82 MAPT (0.51) MAPTNPC1RAB9AKDM4EQPCT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2560953-B1 INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2016-01-06 EP disclosed
US-8541596-B2 Inhibitors PROBIODRUG AG (DE) 2013-09-24 US disclosed
EP-2560953-A2 NOVEL INHIBITORS Probiodrug AG (DE) 2013-02-27 EP disclosed
WO-2011131748-A2 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-10-27 WO disclosed
US-20110262388-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-10-27 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-20110262388-A1 NOVEL INHIBITORS GLUL, QPCT, GLS MAPT 3971/4885NPC1 4532/4885RAB9A 2737/4885

“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.