SCHEMBL2644030

SCHEMBL2644030

CC(C)Cn1cc(C(=O)O)c2ccc(Cl)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 1/20 0.44
PLK1 P53350 4/20 0.43
CNR1 P21554 2/20 0.43
CNR2 P34972 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
POLB P06746 1/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MYC P01106 1/20 0.41
ICMT O60725 1/20 0.41
MAPT P10636 1/20 0.41
KMO O15229 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
F7 P08709 1/20 0.40
F3 P13726 1/20 0.40
KCNA3 P22001 1/20 0.40
PTGER1 P34995 1/20 0.40

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
SCHEMBL3596003 0.89 ICMT (0.46) PLK1CNR1CNR2POLBCA1
SCHEMBL2643935 0.86 PTGDR2 (0.43) CPT1APLK1CNR1CNR2CA1
SCHEMBL24144836 0.85 ICMT (0.43) CNR1CNR2PDE4APDE4BPDE4C
SCHEMBL2643394 0.84 KDM4E (0.45) CNR1CNR2PDE4APDE4BPDE4C
SCHEMBL2642676 0.84 KDM4E (0.48) CPT1ACNR1CNR2CA1CA2
SCHEMBL2642993 0.82 CNR2 (0.48) CPT1ACNR1CNR2CA1CA2
SCHEMBL5069182 0.80 PLK1 (0.64) PLK1MAPTKAT2B
SCHEMBL2642659 0.80 CNR2 (0.51) CNR1CNR2
SCHEMBL3105145 0.79 SERPINE1 (0.59) CPT1ACNR1CNR2CA1CA2
SCHEMBL612485 0.78 AVPR1A (0.54) CPT1ACNR1CNR2PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100348596-C Indole-3-carboxamides as glucokinase (GK) activators HOFFMANN LA ROCHE (CH) 2007-11-14 CN disclosed
EP-1549638-B1 INDOLE-3-CARBOXAMIDES AS GLUCOKINASE (GK) ACTIVATORS HOFFMANN LA ROCHE (CH) 2007-10-03 EP disclosed
CN-1688574-A Indole-3-carboxamides as glucokinase (GK) activators HOFFMANN LA ROCHE (CH) 2005-10-26 CN 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 CPT1A 111/4885PLK1 4506/4885CNR1 411/4885

“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.