SCHEMBL2506344

SCHEMBL2506344

CC(C)(C)[Si](C)(C)Oc1ccc(-c2cnc(N)c(-c3ccsc3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATR Q13535 5/20 0.47
KCNH2 Q12809 2/20 0.38
CYP2A6 P11509 1/20 0.37
PDE3A Q14432 1/20 0.37
PREP P48147 1/20 0.37
NPC1 O15118 1/20 0.37
NEK2 P51955 4/20 0.36
ADK P55263 1/20 0.35
CHEK1 O14757 1/20 0.35
IDO1 P14902 1/20 0.34
TNK2 Q07912 1/20 0.34

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
SCHEMBL2500547 0.88 KCNH2 (0.43) ATRKCNH2PREPNEK2CHEK1
SCHEMBL12198450 0.83 ATR (0.43) ATRKCNH2PREPNEK2CHEK1
SCHEMBL2502121 0.83 ATR (0.49) ATRNEK2
SCHEMBL2506364 0.82 ATR (0.42) ATRKCNH2PREPNPC1ADK
SCHEMBL2507103 0.81 PRKDC (0.42) ATRKCNH2NEK2
SCHEMBL2500375 0.81 ADK (0.44) ATRKCNH2PREPNEK2ADK
SCHEMBL12198441 0.79 ATR (0.52) ATRKCNH2CYP2A6NEK2ADK
SCHEMBL2506338 0.78 PREP (0.43) ATRPREPNPC1NEK2
SCHEMBL29903476 0.78 PREP (0.43) ATRPREPNPC1NEK2
SCHEMBL2504524 0.78 RAB9A (0.43) ATRKCNH2PREPNPC1NEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9075058-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2015-07-07 US disclosed
US-9075058-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2015-07-07 US disclosed
US-9056840-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2015-06-16 US disclosed
US-9056840-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2015-06-16 US disclosed
US-20150153344-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES JNC CORP (JP) 2015-06-04 US disclosed
US-20150153344-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES JNC CORP (JP) 2015-06-04 US disclosed
US-8883432-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2014-11-11 US disclosed
US-8883432-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2014-11-11 US disclosed
US-20140316137-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES JNC CORP (JP) 2014-10-23 US disclosed
US-20140316137-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES JNC CORP (JP) 2014-10-23 US disclosed
US-20140120538-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES NATIONAL UNIVERSITY CORPORATION TOKYO MEDICAL AND DENTAL UNIVERSITY (JP) 2014-05-01 US disclosed
US-20140120538-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES NATIONAL UNIVERSITY CORPORATION TOKYO MEDICAL AND DENTAL UNIVERSITY (JP) 2014-05-01 US disclosed
US-8642281-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2014-02-04 US disclosed
US-8642281-B2 Coelenterazine analogues and coelenteramide analogues JNC CORPORATION (JP) 2014-02-04 US disclosed
US-20110244481-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES JNC CORPORATION (JP) 2011-10-06 US disclosed
US-20110244481-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES JNC CORPORATION (JP) 2011-10-06 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 (4 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-20140120538-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES CCKAR, SI, GLP1R ATR 4715/4885KCNH2 217/4885CYP2A6 2535/4885
US-20140316137-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES CCKAR, SI, GLP1R ATR 4796/4885KCNH2 251/4885CYP2A6 2732/4885
US-20110244481-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES CCKAR, SI, GLP1R ATR 4715/4885KCNH2 217/4885CYP2A6 2535/4885
US-20150153344-A1 COELENTERAZINE ANALOGUES AND COELENTERAMIDE ANALOGUES CCKAR, SI, GLP1R ATR 4715/4885KCNH2 217/4885CYP2A6 2535/4885

“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.