SCHEMBL2963636

SCHEMBL2963636

COc1cc(CCc2ccccn2)ccn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOX P28300 1/20 0.54
LOXL2 Q9Y4K0 1/20 0.54
CYP2D6 P10635 2/20 0.47
CYP1A2 P05177 1/20 0.47
ABCB1 P08183 2/20 0.46
HTR1A P08908 2/20 0.46
DRD2 P14416 2/20 0.46
ALOX15 P16050 2/20 0.46
HRH3 Q9Y5N1 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ACHE P22303 1/20 0.43
HRH1 P35367 2/20 0.43
ALDH1A1 P00352 3/20 0.42
LMNA P02545 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
RECQL P46063 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL2964822 0.83 LOXL2 (0.61) LOXLOXL2ABCB1
SCHEMBL29223016 0.78 LOXL2 (0.54) LOXLOXL2NPC1RAB9ALMNA
SCHEMBL15769250 0.78 LOX (0.50) LOXLOXL2
SCHEMBL15768969 0.78 LOX (0.50) LOXLOXL2RAB9A
SCHEMBL12093687 0.76 LOXL2 (0.65) LOXLOXL2LMNAKDM4E
SCHEMBL15921447 0.76 CYP2D6 (0.67) CYP2D6CYP1A2ABCB1HTR1ADRD2
SCHEMBL6218599 0.75 LOXL2 (0.73) LOXLOXL2CYP1A2LMNATAAR1
SCHEMBL12093676 0.75 LOXL2 (0.62) LOXLOXL2
SCHEMBL2497237 0.75 LOXL2 (0.62) LOXLOXL2ALDH1A1RECQLKDM4E
SCHEMBL22336235 0.75 LOXL2 (0.68) LOXLOXL2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268868-B2 5-pyridinone substituted indazoles ALBANY MOLECULAR RESEARCH, INC. (US) 2012-09-18 US disclosed
US-8268868-B2 5-pyridinone substituted indazoles ALBANY MOLECULAR RESEARCH, INC. (US) 2012-09-18 US disclosed
US-8268868-B2 5-pyridinone substituted indazoles ALBANY MOLECULAR RESEARCH, INC. (US) 2012-09-18 US disclosed
US-20100105679-A1 5-PYRIDINONE SUBSTITUTED INDAZOLES ALBANY MOLECULAR RESEARCH, INC. (US) 2010-04-29 US disclosed
US-20100105679-A1 5-PYRIDINONE SUBSTITUTED INDAZOLES ALBANY MOLECULAR RESEARCH, INC. (US) 2010-04-29 US disclosed
US-20100105679-A1 5-PYRIDINONE SUBSTITUTED INDAZOLES ALBANY MOLECULAR RESEARCH, INC. (US) 2010-04-29 US disclosed
EP-2121654-A1 5-PYRIDINONE SUBSTITUTED INDAZOLES Albany Molecular Research, Inc. (US) 2009-11-25 EP disclosed
WO-2008086404-A1 5-PYRIDINONE SUBSTITUTED INDAZOLES ALBANY MOLECULAR RESEARCH, INC. (US) 2008-07-17 WO disclosed
WO-2008086404-A1 5-PYRIDINONE SUBSTITUTED INDAZOLES ALBANY MOLECULAR RESEARCH, INC. (US) 2008-07-17 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-20100105679-A1 5-PYRIDINONE SUBSTITUTED INDAZOLES CYP3A5, PDXK, PNPO LOX 1175/4885LOXL2 2868/4885CYP2D6 16/4885

“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.