SCHEMBL2962847

SCHEMBL2962847

O=C(NCCN1CCCCC1)c1cnc2c(c1)ncn2-c1ccc(OCc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
KDR P35968 1/20 0.44
MCHR1 Q99705 4/20 0.42
KCNH2 Q12809 2/20 0.42
EPHX2 P34913 1/20 0.42
GLA P06280 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SCN9A Q15858 2/20 0.41
TRPV1 Q8NER1 1/20 0.40
HRH3 Q9Y5N1 2/20 0.40
GCGR P47871 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 1/20 0.40
SLC6A5 Q9Y345 2/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL2976410 0.99 HPGD (0.45) HPGDKDRMCHR1KCNH2EPHX2
SCHEMBL2973369 0.92 EPHX2 (0.52) HPGDEPHX2L3MBTL1SCN9AABL1
SCHEMBL2971081 0.89 SLC6A5 (0.42) HPGDSLC6A5
SCHEMBL4065692 0.88 KDR (0.43) HPGDKDRMCHR1KCNH2SCN9A
SCHEMBL1380313 0.88 MAPT (0.50) HPGDEPHX2GLAL3MBTL1
SCHEMBL4069255 0.88 MCHR1 (0.42) HPGDKDRMCHR1KCNH2SCN9A
SCHEMBL1380711 0.87 MEN1 (0.51) HPGDEPHX2GLAL3MBTL1
SCHEMBL2970729 0.86 HPGD (0.47) HPGDEPHX2TRPV1ABL1
SCHEMBL2961360 0.85 HPGD (0.44) HPGDKCNH2EPHX2
SCHEMBL2973781 0.85 ALOX5 (0.47) HPGDMCHR1SLC6A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767673-B2 N-substituted imidazopyridine c-Kit inhibitors OSI PHARMACEUTICALS, INC. (US) 2010-08-03 US claimed
EP-1658289-B1 3-SUBSTITUTED IMIDAZOPYRIDINE-DERIVATIVES AS C-KIT INHIBITORS OSI PHARM INC (US) 2009-03-18 EP claimed
US-20090062275-A1 N-Substituted Imidazopyridine c-Kit Inhibitors OSI PHARMACEUTICALS, INC. 2009-03-05 US claimed
US-20080221153-A9 N3-SUBSTITUTED IMIDAZOPYRIDINE C-KIT INHIBITORS CASTELHANO ARLINDO L 2008-09-11 US claimed
JP-2007502822-A 2007-02-15 JP claimed
EP-1658289-A2 3-SUBSTITUTED IMIDAZOPYRIDINE-DERIVATIVES AS C-KIT INHIBITORS OSI Pharmaceuticals, Inc. (US) 2006-05-24 EP claimed
US-20060035921-A1 N3-substituted imidazopyridine c-Kit inhibitors CASTELHANO ARLINDO L 2006-02-16 US claimed
WO-2005021544-A2 N3-SUBSTITUTED IMIDAZOPYRIDINE-DERIVATIVES AS C-KIT INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2005-03-10 WO claimed
US-7767673-B2 N-substituted imidazopyridine c-Kit inhibitors OSI PHARMACEUTICALS, INC. (US) 2010-08-03 US disclosed
EP-1658289-B1 3-SUBSTITUTED IMIDAZOPYRIDINE-DERIVATIVES AS C-KIT INHIBITORS OSI PHARM INC (US) 2009-03-18 EP disclosed
US-20090062275-A1 N-Substituted Imidazopyridine c-Kit Inhibitors OSI PHARMACEUTICALS, INC. 2009-03-05 US disclosed
US-7442709-B2 N3-substituted imidazopyridine c-Kit inhibitors OSI PHARMACEUTICALS, INC. (US) 2008-10-28 US disclosed
US-20080221153-A9 N3-SUBSTITUTED IMIDAZOPYRIDINE C-KIT INHIBITORS CASTELHANO ARLINDO L 2008-09-11 US disclosed
US-20060035921-A1 N3-substituted imidazopyridine c-Kit inhibitors CASTELHANO ARLINDO L 2006-02-16 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-20090062275-A1 N-Substituted Imidazopyridine c-Kit Inhibitors KIT, ABL1, CHUK HPGD 666/4885KDR 53/4885MCHR1 3735/4885
US-20080221153-A9 N3-SUBSTITUTED IMIDAZOPYRIDINE C-KIT INHIBITORS KIT, ABL1, CHUK HPGD 1281/4885KDR 37/4885MCHR1 3444/4885
US-20060035921-A1 N3-substituted imidazopyridine c-Kit inhibitors KIT, ABL1, CHUK HPGD 1281/4885KDR 37/4885MCHR1 3444/4885

“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.