SCHEMBL2540200

SCHEMBL2540200

Clc1ccc(CNc2ccc3[nH]cnc3c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
QPCT Q16769 1/20 0.54
GFER P55789 1/20 0.53
POLB P06746 2/20 0.50
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
IP6K1 Q92551 1/20 0.47
P2RY14 Q15391 1/20 0.45
EGFR P00533 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
GAA P10253 1/20 0.42

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
SCHEMBL24125161 0.90 PPARA (0.52) RAB9ANPC1QPCTGFERPOLB
SCHEMBL2539376 0.89 QPCT (0.67) RAB9ANPC1QPCTGFERPOLB
SCHEMBL2538614 0.86 NPC1 (0.56) RAB9ANPC1QPCTGFERPOLB
SCHEMBL2538625 0.85 IP6K1 (0.63) RAB9AQPCTLMNAMAPTSMN1; SMN2
SCHEMBL2545579 0.82 RAB9A (0.55) RAB9ANPC1QPCTLMNAMAPT
SCHEMBL2546606 0.82 MAPT (0.58) RAB9ANPC1QPCTPOLBLMNA
SCHEMBL2543317 0.82 KMT2A (0.58) RAB9ANPC1QPCTGFERLMNA
SCHEMBL2546278 0.82 QPCT (0.46) RAB9ANPC1QPCTLMNAMAPT
SCHEMBL3633215 0.81 QPCT (0.83) QPCTLMNASMN1; SMN2MEN1KMT2A
SCHEMBL21303627 0.80 RAB9A (0.47) RAB9ANPC1QPCTGFERPOLB

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 RAB9A 2737/4885NPC1 4532/4885QPCT 2/4885

“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.