SCHEMBL3034252

SCHEMBL3034252

c1ccc(-c2cc(-c3cnc4cc(-c5ccc(CN6CCCCC6)cc5)ccn34)ccn2)cc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.60
FLT3 P36888 4/20 0.52
TGFBR1 P36897 2/20 0.50
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
CHEK1 O14757 1/20 0.42
ACHE P22303 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
SCHEMBL3032546 0.86 KDR (0.51) KDRFLT3
SCHEMBL3032375 0.84 KDR (0.73) KDRFLT3CHEK1
SCHEMBL3030308 0.83 KDR (0.54) KDRFLT3
SCHEMBL3021367 0.83 CHEK1 (0.51) KDRFLT3TGFBR1CHEK1
SCHEMBL3026155 0.81 KDR (0.70) KDRFLT3
SCHEMBL3030300 0.81 KDR (0.57) KDR
SCHEMBL3026707 0.81 KDR (0.53) KDRFLT3TGFBR1CHEK1
SCHEMBL3035701 0.81 KDR (0.56) KDRFLT3
SCHEMBL3034003 0.81 KDR (0.80) KDRFLT3CHEK1
SCHEMBL3033573 0.79 KDR (0.54) KDRFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 372/4885FLT3 4384/4885TGFBR1 11/4885

“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.