SCHEMBL16664631

SCHEMBL16664631

Cc1cc(N/N=C(\C#N)C(=O)c2cc(C(C)(C)C)on2)cc(C(F)(F)F)c1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RAPGEF3 O95398 10/20 0.88

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
SCHEMBL15941311 0.94 RAPGEF3 (1.00) RAPGEF3
SCHEMBL15188849 0.94 RAPGEF3 (1.00) RAPGEF3
SCHEMBL15188836 0.86 RAPGEF3 (0.81) RAPGEF3
SCHEMBL15940957 0.86 RAPGEF3 (0.81) RAPGEF3
SCHEMBL15176262 0.83 RAPGEF3 (0.72) RAPGEF3
SCHEMBL15176263 0.83 RAPGEF3 (0.72) RAPGEF3
SCHEMBL15176035 0.82 RAPGEF3 (0.79) RAPGEF3
SCHEMBL15176034 0.82 RAPGEF3 (0.79) RAPGEF3
SCHEMBL15175346 0.81 RAPGEF3 (1.00) RAPGEF3
SCHEMBL15175342 0.81 RAPGEF3 (1.00) RAPGEF3

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-2811990-B1 MODULATORS OF EXCHANGE PROTEINS DIRECTLY ACTIVATED BY CAMP (EPACS) UNIV TEXAS (US) 2017-10-25 EP disclosed
US-9737512-B2 Methods and compositions for treating chronic pain THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-08-22 US disclosed
US-9539256-B2 Modulators of exchange proteins directly activated by cAMP (EPACS) THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-01-10 US disclosed
US-20160263088-A1 Methods and Compositions for Treating Chronic Pain THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2016-09-15 US disclosed
US-20150110809-A1 MODULATORS OF EXCHANGE PROTEINS DIRECTLY ACTIVATED BY CAMP (EPACS) THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-04-23 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-20150110809-A1 MODULATORS OF EXCHANGE PROTEINS DIRECTLY ACTIVATED BY CAMP (EPACS) RAPGEF3, RAPGEF4, CREB1 RAPGEF3 1/4885
US-20160263088-A1 Methods and Compositions for Treating Chronic Pain PLA2G4C, GAP43, PTGER2 RAPGEF3 25/4885

“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.