SCHEMBL2643468

SCHEMBL2643468

CC(C)n1cc(C(=O)C(F)(F)F)c2ccc(Cl)cc21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.46
IDO1 P14902 3/20 0.39
KDM4E B2RXH2 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
PTGER1 P34995 1/20 0.37
NTRK1 P04629 7/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
PLA2G4A P47712 1/20 0.35
TPSAB1 Q15661 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
ACHE P22303 1/20 0.35

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
SCHEMBL2642580 0.85 HTT (0.47) HTTIDO1KDM4EFFAR4NTRK1
SCHEMBL2642679 0.85 HTT (0.50) HTTIDO1KDM4EFFAR4NTRK1
SCHEMBL2642785 0.84 HTT (0.46) HTTIDO1KDM4EPTGER1NTRK1
SCHEMBL2642669 0.84 IDO1 (0.46) HTTIDO1KDM4ERXRARXRB
SCHEMBL2642632 0.83 PTGDR2 (0.42) KDM4EFFAR4PTGER1PLA2G4APTGDR2
SCHEMBL2643320 0.83 HTT (0.45) HTTIDO1KDM4EFFAR4NTRK1
SCHEMBL28849060 0.82 HTT (0.64) HTTIDO1KDM4ERXRARXRB
SCHEMBL2643777 0.82 HTT (0.44) HTTIDO1KDM4ENTRK1RXRA
SCHEMBL2643394 0.81 KDM4E (0.45) HTTIDO1KDM4EPTGER1TPSAB1
SCHEMBL29052319 0.80 HTT (0.66) HTTIDO1KDM4ETPSAB1

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-1549638-B1 INDOLE-3-CARBOXAMIDES AS GLUCOKINASE (GK) ACTIVATORS HOFFMANN LA ROCHE (CH) 2007-10-03 EP disclosed
EP-1549638-A1 INDOLE-3-CARBOXAMIDES AS GLUCOKINASE (GK) ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-07-06 EP disclosed
US-6881844-B2 Indole-3-carboxamides as glucokinase activators HOFFMAN-LA ROCHE INC. (US) 2005-04-19 US disclosed
WO-2004031179-A1 INDOLE-3-CARBOXAMIDES AS GLUCOKINASE (GK) ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-15 WO disclosed
US-20040067939-A1 Indole-3-carboxamides as glucokinase activators CORBETT WENDY LEA (US) 2004-04-08 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-20040067939-A1 Indole-3-carboxamides as glucokinase activators GCKR, GPR119, GCK HTT 2902/4885IDO1 30/4885KDM4E 2630/4885

“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.