SCHEMBL5961510

SCHEMBL5961510

Cc1nn(C)c2ncc(N(C=O)C(=O)Nc3ccc(C(=O)N4CCN(C)CC4)c(Cl)c3)cc12

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTK6 Q13882 8/20 0.42
MTOR P42345 2/20 0.38
KDR P35968 1/20 0.38
NR3C1 P04150 4/20 0.37
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
PIK3CA P42336 1/20 0.36
PDE7A Q13946 1/20 0.36
CCR2 P41597 1/20 0.35
CCR5 P51681 1/20 0.35
LCK P06239 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
SPR P35270 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
SCHEMBL5961540 0.92 LCK (0.42) PTK6MTORNR3C1LCK
SCHEMBL7137484 0.84 SPR (0.43) NR3C1POLBCCR2CCR5LMNA
SCHEMBL5961443 0.83 PTK6 (0.40) PTK6MTORNR3C1
SCHEMBL7074009 0.82 NR3C1 (0.48) NR3C1POLBCCR2CCR5SPR
SCHEMBL7079006 0.80 MEN1 (0.45) NR3C1POLBHPGDCCR2CCR5
SCHEMBL5961577 0.79 CCR2 (0.51) KDRNR3C1CCR2CCR5
SCHEMBL5961460 0.78 NR3C1 (0.40) PTK6MTORNR3C1LCK
SCHEMBL7077952 0.78 SPR (0.48) NR3C1POLBCCR2CCR5SPR
SCHEMBL7079264 0.78 NR3C1 (0.40) NR3C1POLBCCR2CCR5SPR
SCHEMBL5961570 0.77 NR3C1 (0.39) KDRNR3C1LMNATP53ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6670364-B2 For example (1,3-dimethylpyrazolo(5,4-b)pyridin-5-yl)-N-(((4-fluorophenyl) amino)carbonyl)-carboxamide; useful in prevention or treatment of chronic or acute inflammatory or autoimmune diseases TELIK, INC. 2003-12-30 US claimed
EP-1358188-A2 ANTAGONISTS OF MCP-1 FUNCTION AND METHODS OF USE THEREOF TELIK, INC. (US) 2003-11-05 EP claimed
US-20030096705-A1 Antagonists of MCP-1 function and methods of use thereof SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2003-05-22 US claimed
WO-2002060900-A2 ANTAGONISTS OF MCP-1 FUNCTION AND METHODS OF USE THEREOF TELIK, INC. (US) 2002-08-08 WO claimed
US-6992086-B2 Antagonists of MCP-1 function and methods of use thereof TELIK, INC. (US) 2006-01-31 US disclosed
US-6670364-B2 For example (1,3-dimethylpyrazolo(5,4-b)pyridin-5-yl)-N-(((4-fluorophenyl) amino)carbonyl)-carboxamide; useful in prevention or treatment of chronic or acute inflammatory or autoimmune diseases TELIK, INC. 2003-12-30 US disclosed
EP-1322673-A1 POLYSACCHARIDES WITH ANTITHROMBOTIC ACTIVITY COMPRISING AT LEAST A COVALENT BOND WITH BIOTIN OR A BIOTIN DERIVATIVE Sanofi-Aventis (FR) 2003-07-02 EP disclosed
WO-2002024754-A1 POLYSACCHARIDES WITH ANTITHROMBOTIC ACTIVITY COMPRISING AT LEAST A COVALENT BOND WITH BIOTIN OR A BIOTIN DERIVATIVE SANOFI-SYNTHELABO (FR) 2002-03-28 WO 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-20030096705-A1 Antagonists of MCP-1 function and methods of use thereof CCR2, CCR1, CCL2 PTK6 2002/4885MTOR 4156/4885KDR 1267/4885

“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.