SCHEMBL2642669

SCHEMBL2642669

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

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 12/20 0.46
HTT P42858 2/20 0.46
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
EPHX2 P34913 1/20 0.41
KDM4E B2RXH2 1/20 0.39
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
PDGFRA P16234 1/20 0.35
CDK5 Q00535 1/20 0.35
TYRO3 Q06418 1/20 0.35
TPSAB1 Q15661 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL29051458 0.89 IDO1 (0.55) IDO1HTTLMNAMEN1KMT2A
SCHEMBL2642679 0.85 HTT (0.50) IDO1HTTLMNAMEN1KMT2A
SCHEMBL2642580 0.85 HTT (0.47) IDO1HTTKDM4ERXRARXRB
SCHEMBL1622103 0.84 MYC (0.42) HTTLMNAMEN1KMT2AKDM4E
SCHEMBL2642785 0.84 HTT (0.46) IDO1HTTKDM4ERXRARXRB
SCHEMBL2643468 0.84 HTT (0.46) IDO1HTTKDM4ERXRARXRB
SCHEMBL2643320 0.83 HTT (0.45) IDO1HTTLMNAMEN1KMT2A
SCHEMBL29164497 0.82 HTT (0.64) IDO1HTTLMNAMEN1KMT2A
SCHEMBL2643777 0.82 HTT (0.44) IDO1HTTKDM4ERXRARXRB
SCHEMBL24144439 0.81 IDO1 (0.52) IDO1HTTLMNAMEN1KMT2A

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 IDO1 30/4885HTT 2902/4885LMNA 4752/4885

“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.