SCHEMBL3030308

SCHEMBL3030308

CN1CCN(Cc2cccc(-c3ccn4c(-c5ccnc(-c6ccccc6)c5)cnc4c3)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.54
ABL1 P00519 1/20 0.47
KIT P10721 1/20 0.47
BCR P11274 1/20 0.47
DDR1 Q08345 1/20 0.47
FLT3 P36888 3/20 0.45
ACVR1 Q04771 1/20 0.44
FYN P06241 1/20 0.43
NEK2 P51955 1/20 0.42
CXCR4 P61073 1/20 0.42

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
SCHEMBL3031800 0.89 KDR (0.47) KDRABL1KITBCRDDR1
SCHEMBL3021367 0.89 CHEK1 (0.51) KDRFLT3
SCHEMBL3025456 0.88 KDR (0.44) KDRFLT3ACVR1FYN
SCHEMBL3034252 0.83 KDR (0.60) KDRFLT3
SCHEMBL3028730 0.82 FYN (0.61) KDRFLT3ACVR1FYN
SCHEMBL3015246 0.81 KDR (0.48) KDRABL1KITBCRDDR1
SCHEMBL3035743 0.81 KDR (0.53) KDRFLT3
SCHEMBL3032375 0.80 KDR (0.73) KDRFLT3FYN
SCHEMBL3324505 0.79 KDR (0.57) KDRABL1KITBCRDDR1
SCHEMBL15184702 0.78 KDR (0.50) KDRABL1KITBCRDDR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2212323-B1 IMIDAZO [1,2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS NOVARTIS AG (CH) 2012-08-15 EP claimed
US-8367662-B2 Organic compounds NOVARTIS AG (CH) 2013-02-05 US disclosed
EP-2212323-B1 IMIDAZO [1,2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS NOVARTIS AG (CH) 2012-08-15 EP disclosed
US-20100210641-A1 Organic Compounds NOVARTIS AG (CH) 2010-08-19 US disclosed
EP-2212323-A2 IMIDAZO [1,2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS Novartis AG (CH) 2010-08-04 EP disclosed
WO-2009050183-A2 IMIDAZO [1, 2-A] PYRIDINE DERIVATIVES USEFUL AS ALK INHIBITORS NOVARTIS AG (CH) 2009-04-23 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-20100210641-A1 Organic Compounds ALK, ACVR1, ACVRL1 KDR 372/4885ABL1 1808/4885KIT 918/4885

“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.