SCHEMBL10016360

SCHEMBL10016360

COc1nc(Nc2cccc(C(F)(F)F)c2)nc(OC)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 1.00
LMNA P02545 2/20 1.00
MAPK1 P28482 1/20 1.00
IDH2 P48735 7/20 0.68
APP P05067 3/20 0.63
ABCG2 Q9UNQ0 1/20 0.60
AURKA O14965 2/20 0.55
KDM4E B2RXH2 1/20 0.53
KIF11 P52732 1/20 0.52

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
SCHEMBL1391806 0.85 MAPT (0.73) MAPTLMNAMAPK1IDH2APP
SCHEMBL30568833 0.81 IDH2 (1.00) MAPTLMNAMAPK1IDH2APP
SCHEMBL4544808 0.79 IDH2 (0.77) MAPTLMNAMAPK1IDH2APP
SCHEMBL1391970 0.79 IDH2 (0.75) MAPTLMNAMAPK1IDH2APP
SCHEMBL15033703 0.78 MAPT (0.63) MAPTLMNAMAPK1IDH2APP
SCHEMBL30933606 0.78 MAPT (0.63) MAPTLMNAMAPK1IDH2APP
SCHEMBL10282670 0.78 LMNA (0.63) MAPTLMNAMAPK1IDH2APP
SCHEMBL24700899 0.78 IDH2 (0.75) MAPTLMNAMAPK1IDH2APP
SCHEMBL28455381 0.78 IDH2 (0.91) MAPTLMNAMAPK1IDH2APP
SCHEMBL1393001 0.78 LMNA (0.62) MAPTLMNAMAPK1IDH2APP

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-20140255386-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME NORTH CAROLINA STATE UNIVERSITY (US) 2014-09-11 US disclosed
US-20140255386-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME NORTH CAROLINA STATE UNIVERSITY (US) 2014-09-11 US disclosed
WO-2013019469-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME THE WISTAR INSTITUTE (US) 2013-02-07 WO disclosed
US-20130023498-A1 MicroRNA Modulators and Method for Identifying and Using the Same The Wistar Institute and North Carolina State University 2013-01-24 US disclosed
US-20130023498-A1 MicroRNA Modulators and Method for Identifying and Using the Same The Wistar Institute and North Carolina State University 2013-01-24 US disclosed
US-20120010177-A1 MicroRNA Modulators and Method for Identifying And Using The Same The Wistar Institute / North Carolina State University (US) 2012-01-12 US disclosed
US-20120010177-A1 MicroRNA Modulators and Method for Identifying And Using The Same The Wistar Institute / North Carolina State University (US) 2012-01-12 US disclosed
US-20100196357-A1 Microrna modulators and method for identifying and using the same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-08-05 US disclosed
US-20100196357-A1 Microrna modulators and method for identifying and using the same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-08-05 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-20100196357-A1 Microrna modulators and method for identifying and using the same AGO2, RNASE1, TRDMT1 MAPT 4079/4885LMNA 2926/4885MAPK1 2787/4885
US-20130023498-A1 MicroRNA Modulators and Method for Identifying and Using the Same AGO2, RNASE1, TRDMT1 MAPT 4079/4885LMNA 2926/4885MAPK1 2787/4885
US-20120010177-A1 MicroRNA Modulators and Method for Identifying And Using The Same AGO2, RNASE1, TRDMT1 MAPT 4079/4885LMNA 2926/4885MAPK1 2787/4885
US-20140255386-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME AGO2, RNASE1, TRDMT1 MAPT 4079/4885LMNA 2926/4885MAPK1 2787/4885

“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.