SCHEMBL4763680

SCHEMBL4763680

CCOC(=O)c1ccnc(-c2ccccc2)c1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 7/20 0.67
MAPT P10636 3/20 0.61
LMNA P02545 1/20 0.61
TP53 P04637 1/20 0.61
THRB P10828 1/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
ALDH1A1 P00352 2/20 0.52
KDM4E B2RXH2 1/20 0.50
KDM6B O15054 1/20 0.50
KDM5C P41229 1/20 0.50
KDM4C Q9H3R0 1/20 0.50
KDM2A Q9Y2K7 1/20 0.50
KDM3A Q9Y4C1 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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 0.97 JMJD6 (0.64) JMJD6MAPTLMNATP53THRB
SCHEMBL4763737 0.88 JMJD6 (0.61) JMJD6MAPTLMNATP53THRB
SCHEMBL811785 0.88 JMJD6 (0.76) JMJD6KDM4EKDM6BKDM5CKDM4C
SCHEMBL30171421 0.88 JMJD6 (0.76) JMJD6KDM4EKDM6BKDM5CKDM4C
SCHEMBL31417865 0.86 JMJD6 (0.56) JMJD6MAPTLMNATP53THRB
SCHEMBL4770697 0.86 JMJD6 (0.59) JMJD6MAPTLMNATP53THRB
SCHEMBL4768876 0.86 JMJD6 (0.59) JMJD6MAPTLMNATP53THRB
SCHEMBL30614246 0.85 JMJD6 (0.65) JMJD6LMNANPC1RAB9AKDM4E
SCHEMBL2301563 0.85 JMJD6 (0.65) JMJD6LMNANPC1RAB9AKDM4E
SCHEMBL28332640 0.85 JMJD6 (0.61) 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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109053815-B Iridium (III) complex and preparation method and application thereof 南京工业大学 2019-12-10 CN claimed
CN-109053815-B Iridium (III) complex and preparation method and application thereof 南京工业大学 2019-12-10 CN disclosed
CN-109053815-B Iridium (III) complex and preparation method and application thereof 南京工业大学 2019-12-10 CN disclosed
CN-109053815-A Iridium (III) complex and preparation method and application thereof 南京工业大学 2018-12-21 CN disclosed
US-7635695-B2 Antiinflammation agents AMGEN INC. (US) 2009-12-22 US disclosed
US-7635695-B2 Antiinflammation agents AMGEN INC. (US) 2009-12-22 US disclosed
EP-1400513-B1 UNSYMMETRICAL CYCLIC DIAMINE COMPOUND KOWA CO (JP) 2008-01-09 EP disclosed
US-20070155777-A1 Antiinflammation agents AMGEN, INC. 2007-07-05 US disclosed
US-20070155777-A1 Antiinflammation agents AMGEN, INC. 2007-07-05 US disclosed
US-7199119-B2 Antiinflammation agents AMGEN INC. (US) 2007-04-03 US disclosed
US-7199119-B2 Antiinflammation agents AMGEN INC. (US) 2007-04-03 US 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 (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-20030022887-A1 Unsymmetrical cyclic diamine compound H1-0, DDAH1, AOC1 JMJD6 1967/4885MAPT 4305/4885LMNA 2188/4885
US-20070155777-A1 Antiinflammation agents TNF, NFATC1, NFKBIA JMJD6 2527/4885MAPT 3631/4885LMNA 4103/4885

“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.