SCHEMBL4770741

SCHEMBL4770741

CCOC(=O)c1ccnc(-c2ccc3ccccc3c2)c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 6/20 0.55
JAK2 O60674 1/20 0.51
JAK3 P52333 1/20 0.51
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
CTRC Q99895 1/20 0.49
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
TP53 P04637 1/20 0.47
THRB P10828 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL4763698 0.85 JMJD6 (0.64) JMJD6NPC1RAB9AMAPTLMNA
SCHEMBL29141528 0.85 KDM4E (0.58) JMJD6NPC1RAB9ACTRCSLC6A2
SCHEMBL4763680 0.85 JMJD6 (0.67) JMJD6NPC1RAB9AMAPTLMNA
SCHEMBL7179755 0.85 PLAU (0.53) TP53SLC6A2SLC6A4SLC6A3
SCHEMBL4763737 0.82 JMJD6 (0.61) JMJD6NPC1RAB9AMAPTLMNA
SCHEMBL811785 0.82 JMJD6 (0.76) JMJD6
SCHEMBL30171421 0.82 JMJD6 (0.76) JMJD6
SCHEMBL4766855 0.82 JMJD6 (0.57) JMJD6NPC1RAB9AMAPTTP53
SCHEMBL1646106 0.81 JMJD6 (0.55) JMJD6JAK2JAK3
SCHEMBL4768424 0.81 JMJD6 (0.54) JMJD6MAPTLMNATP53THRB

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-1400513-B1 UNSYMMETRICAL CYCLIC DIAMINE COMPOUND KOWA CO (JP) 2008-01-09 EP disclosed
EP-1400513-B1 UNSYMMETRICAL CYCLIC DIAMINE COMPOUND KOWA CO (JP) 2008-01-09 EP disclosed
EP-1400513-A1 UNSYMMETRICAL CYCLIC DIAMINE COMPOUND Kowa Co., Ltd. (JP) 2004-03-24 EP disclosed
US-6552188-B2 Inhibit cell adhesion and cell infiltration; useful treating asthma, allergies, rheumatic diseases, arteriosclerosis, and inflammation; 2-(3,4,5-trimethoxyphenyl),4-((4-substituted piperazin-1-yl)methyl)pyridine compounds KOWA CO., LTD. (JP) 2003-04-22 US disclosed
US-20030022887-A1 Unsymmetrical cyclic diamine compound KOWA CO., LTD. (JP) 2003-01-30 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-20030022887-A1 Unsymmetrical cyclic diamine compound H1-0, DDAH1, AOC1 JMJD6 1967/4885JAK2 983/4885JAK3 1932/4885

“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.