SCHEMBL3025359

SCHEMBL3025359

CC(C)NCc1cccc(-c2ccn3c(-c4ccnc(C5=CCCC5)c4)cnc3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.40
FGFR3 P22607 13/20 0.40
FLT3 P36888 1/20 0.37
HTR1A P08908 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA3 P34903 1/20 0.37

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
SCHEMBL3020043 0.91 KDR (0.41) KDRFGFR3FLT3GABRG2GABRB3
SCHEMBL3022577 0.90 KDR (0.40) KDRFGFR3FLT3HTR1AGABRG2
SCHEMBL3015835 0.87 KDR (0.40) KDRFGFR3FLT3HTR1AGABRG2
SCHEMBL3026450 0.86 KDR (0.39) KDRFGFR3HTR1A
SCHEMBL3022581 0.83 KDR (0.41) KDRFGFR3FLT3GABRG2GABRB3
SCHEMBL3033317 0.83 KDR (0.58) KDRFGFR3FLT3GABRG2GABRB3
SCHEMBL3032130 0.82 FLT3 (0.47) KDRFGFR3FLT3GABRG2GABRB3
SCHEMBL3015840 0.81 KDR (0.40) KDRFGFR3FLT3
SCHEMBL3020624 0.80 KDR (0.46) KDRFGFR3FLT3GABRG2GABRB3
SCHEMBL3022546 0.80 KDR (0.49) KDRFGFR3

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 372/4885FGFR3 32/4885FLT3 4384/4885

“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.