SCHEMBL13342175

SCHEMBL13342175

CCN1CCN(C(=O)c2cc(F)cc(-c3cnc4[nH]cc(-c5ccccc5OC)c4c3)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.53
MAP4K1 Q92918 3/20 0.49
KIT P10721 4/20 0.49
AXL P30530 1/20 0.49
MAP3K11 Q16584 6/20 0.47
CAMKK2 Q96RR4 1/20 0.44
NTRK1 P04629 1/20 0.43
CCND1 P24385 1/20 0.43
CDK6 Q00534 1/20 0.43
TNIK Q9UKE5 1/20 0.43

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
SCHEMBL13342180 0.91 ABL1 (0.56) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342291 0.90 ABL1 (0.51) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342331 0.90 ABL1 (0.56) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342261 0.90 ABL1 (0.54) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL12762903 0.89 ABL1 (0.65) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342267 0.89 ABL1 (0.53) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342254 0.88 KIT (0.49) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342240 0.86 MAP4K1 (0.54) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342262 0.85 MAP4K1 (0.51) ABL1MAP4K1KITAXLMAP3K11
SCHEMBL13342327 0.85 ABL1 (0.48) ABL1MAP4K1KITAXLMAP3K11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7709645-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2010-05-04 US disclosed
US-7601839-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS INC. (US) 2009-10-13 US disclosed
US-7601839-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS INC. (US) 2009-10-13 US disclosed
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS SGX PHARMACEUTICALS, INC. (US) 2009-06-04 US disclosed
US-20090005378-A1 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2009-01-01 US disclosed
US-20090005378-A1 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2009-01-01 US disclosed
WO-2008124849-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 WO disclosed
US-7361764-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2008-04-22 US disclosed
US-7361764-B2 Pyrrolo-pyridine kinase modulators SGX PHARMACEUTICALS, INC. (US) 2008-04-22 US disclosed
US-20070043068-A1 to treat diseases mediated by kinase activity; for example: [3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridine-5-yl]-methyl-phenyl-amine SGX PHARMACEUTICALS, INC. (US) 2007-02-22 US disclosed
US-20070043068-A1 to treat diseases mediated by kinase activity; for example: [3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridine-5-yl]-methyl-phenyl-amine SGX PHARMACEUTICALS, INC. (US) 2007-02-22 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 (3 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-20090005378-A1 PYRROLO-PYRIDINE KINASE MODULATORS MAP3K20, MAP4K2, MAP3K19 ABL1 235/4885MAP4K1 6/4885KIT 1181/4885
US-20070043068-A1 to treat diseases mediated by kinase activity; for example: [3-(2-methoxy-phenyl)-1H-pyrrolo[2,3-b]pyridine-5-yl]-methyl-phenyl-amine MAP3K20, MAP4K2, MAP3K6 ABL1 96/4885MAP4K1 14/4885KIT 1238/4885
US-20090143352-A1 PYRROLO-PYRIDINE KINASE MODULATIORS MAP4K2, PDXK, MAP4K1 ABL1 348/4885MAP4K1 3/4885KIT 1085/4885

“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.