SCHEMBL118944

SCHEMBL118944

Cc1nc(N)ccc1OCCOC1CCCCO1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MCHR1 Q99705 4/20 0.39
▸ DHFR P00374 1/20 0.35
▸ NCF1 P14598 7/20 0.34
▸ CYBB P04839 2/20 0.34
▸ P2RX3 P56373 2/20 0.34
▸ NOX5 Q96PH1 1/20 0.33

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
SCHEMBL117686 0.81 KDM4C (0.41) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL17767936 0.78 KDM4C (0.46) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL17768193 0.78 KDM4C (0.49) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL4988791 0.76 NPC1 (0.44) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL15508893 0.76 NPC1 (0.46) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL12959495 0.76 KDM4C (0.45) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL15508907 0.75 MEN1 (0.42) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL19175392 0.74 KDM4C (0.43) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL171700 0.74 L3MBTL1 (0.50) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL15508886 0.74 KDM4C (0.43) KDM4CNPC1RAB9AL3MBTL1MEN1

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
US-20120101093-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS BETA-SECRETASE INHIBITORS HIGH POINT PHARMACEUTICALS, LLC (US) 2012-04-26 — — US disclosed
EP-2424866-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS -SECRETASE INHIBITORS High Point Pharmaceuticals, LLC (US) 2012-03-07 — — EP disclosed
WO-2010126745-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS β-SECRETASE INHIBITORS HIGH POINT PHARMACEUTICALS, LLC (US) 2010-11-04 — — WO 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-20120101093-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS BETA-SECRETASE INHIBITORS BACE1, BACE2, APP KDM4C 2948/4885NPC1 289/4885RAB9A 2165/4885

“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.

Send feedback