SCHEMBL15965809

SCHEMBL15965809

Nc1cccnc1NC1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
GAA P10253 2/20 0.52
MAPT P10636 1/20 0.51
HSD17B10 Q99714 1/20 0.49
HPGDS O60760 2/20 0.44
LRRK2 Q5S007 3/20 0.43
PDE5A O76074 2/20 0.42
ACP1 P24666 2/20 0.42
GBA1 P04062 4/20 0.42
MERTK Q12866 1/20 0.42
OGG1 O15527 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41
LMNA P02545 1/20 0.41
HSP90AA1 P07900 1/20 0.41
SLC2A1 P11166 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
NCOA1 Q15788 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
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
SCHEMBL21093636 0.98 KDM4E (0.55) KDM4EGAAMAPTHSD17B10HPGDS
SCHEMBL19851082 0.98 KDM4E (0.55) KDM4EGAAMAPTHSD17B10HPGDS
SCHEMBL5775863 0.98 KDM4E (0.55) KDM4EGAAMAPTHSD17B10HPGDS
SCHEMBL5778944 0.98 KDM4E (0.55) KDM4EGAAMAPTHSD17B10HPGDS
SCHEMBL5800694 0.98 KDM4E (0.55) KDM4EGAAMAPTHSD17B10HPGDS
Hydrochloric Acid SCHEMBL11561576 0.97 KDM4E (0.53) KDM4EGAAMAPTHSD17B10HPGDS
SCHEMBL5958267 0.93 UTS2R (0.43) KDM4EGAAMAPTHSD17B10LRRK2
SCHEMBL26349385 0.85 HRH3 (0.51) KDM4EMAPTHSD17B10MERTKLMNA
SCHEMBL13351533 0.82 BRD4 (0.47) GAASMN1; SMN2
SCHEMBL16444546 0.80 ALDH1A1 (0.40) KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9815832-B2 Azabenzimidazole compounds PFIZER INC. (US) 2017-11-14 US disclosed
US-9815832-B2 Azabenzimidazole compounds PFIZER INC. (US) 2017-11-14 US disclosed
EP-2958915-B1 AZABENZIMIDAZOLE COMPOUNDS AS INHIBITORS OF PDE4 ISOZYMES FOR THE TREATMENT OF CNS AND OTHER DISORDERS PFIZER (US) 2017-07-05 EP disclosed
US-20150322065-A1 Azabenzimidazole Compounds PFIZER (US) 2015-11-12 US disclosed
US-20150322065-A1 Azabenzimidazole Compounds PFIZER (US) 2015-11-12 US disclosed
US-9120788-B2 Azabenzimidazole compounds PFIZER INC. (US) 2015-09-01 US disclosed
US-9120788-B2 Azabenzimidazole compounds PFIZER INC. (US) 2015-09-01 US disclosed
WO-2014128585-A1 AZABENZIMIDAZOLE COMPOUNDS AS INHIBITORS OF PDE4 ISOZYMES FOR THE TREATMENT OF CNS AND OTHER DISORDERS PFIZER INC. (US) 2014-08-28 WO disclosed
US-20140235612-A1 Azabenzimidazole Compounds PFIZER (US) 2014-08-21 US disclosed
US-20140235612-A1 Azabenzimidazole Compounds PFIZER (US) 2014-08-21 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 (2 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-20150322065-A1 Azabenzimidazole Compounds AZI2, HDAC6, ABL1 KDM4E 237/4885GAA 555/4885MAPT 4007/4885
US-20140235612-A1 Azabenzimidazole Compounds AZI2, HDAC6, ABL1 KDM4E 237/4885GAA 555/4885MAPT 4007/4885

“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.