SCHEMBL3845013

SCHEMBL3845013

CN1CCN(c2ccc3[nH]c(-c4c(N)c5ncccc5[nH]c4=O)nc3c2)CC1

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 18/20 0.88
FLT1 P17948 4/20 0.88
PDGFRB P09619 16/20 0.70
KDR P35968 16/20 0.70
LCK P06239 3/20 0.61
FLT3 P36888 2/20 0.61
MAP4K1 Q92918 2/20 0.61
PLK4 O00444 1/20 0.61
STK25 O00506 1/20 0.61
CIT O14578 1/20 0.61
RIOK3 O14730 1/20 0.61
CHEK1 O14757 1/20 0.61
GAK O14976 1/20 0.61
CHUK O15111 1/20 0.61
MUSK O15146 1/20 0.61
EPHB6 O15197 1/20 0.61
PDPK1 O15530 1/20 0.61
MAP3K13 O43283 1/20 0.61
DAPK3 O43293 1/20 0.61
MAP3K7 O43318 1/20 0.61

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
SCHEMBL3381227 0.86 FGFR1 (0.85) FGFR1FLT1PDGFRBKDR
SCHEMBL14795331 0.84 FGFR1 (0.86) FGFR1FLT1PDGFRBKDRLCK
SCHEMBL3841472 0.83 FGFR1 (0.68) FGFR1FLT1PDGFRBKDRLCK
Dovitinib SCHEMBL30567813 0.83 FGFR1 (0.86) FGFR1FLT1PDGFRBKDRLCK
SCHEMBL3381338 0.83 FGFR1 (0.86) FGFR1FLT1PDGFRBKDR
Dovitinib SCHEMBL949705 0.83 FGFR1 (0.86) FGFR1FLT1PDGFRBKDRLCK
SCHEMBL3379948 0.83 FGFR1 (0.86) FGFR1FLT1PDGFRBKDRLCK
SCHEMBL3381059 0.82 FGFR1 (1.00) FGFR1FLT1PDGFRBKDRLCK
Dovitinib SCHEMBL12003201 0.82 FGFR1 (0.85) FGFR1FLT1PDGFRBKDRLCK
SCHEMBL3840360 0.82 FGFR1 (0.86) FGFR1FLT1PDGFRBKDRLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2573079-A2 Benzimidazole quinolinones and uses thereof Novartis Vaccines and Diagnostics, Inc. (US) 2013-03-27 EP disclosed
EP-1313734-B1 AZA HETEROCYCLIC DERIVATIVES AND THEIR THERAPEUTIC USE NOVARTIS VACCINES & DIAGNOSTIC (US) 2009-11-11 EP disclosed
US-7368459-B2 Heterocyclic compounds CHIRON CORPORATION (US) 2008-05-06 US disclosed
US-20070032528-A1 Heterocyclic compounds RENHOWE PAUL A 2007-02-08 US disclosed
US-7138409-B2 Heterocyclic compounds CHIRON CORPORATION (US) 2006-11-21 US disclosed
US-20050137188-A1 Heterocyclic compounds CHIRON CORPORATION 2005-06-23 US disclosed
US-6759417-B2 VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR TYROSINE KINASE INHIBITORS; SUCH AS 7-AMINO-6-(1H-BENZIMIDAZOL-2-YL)-3,4-DIHYDRO-5H-IMIDAZO(4,5-B)PYRIDIN-5-ONE CHIRON CORPORATION 2004-07-06 US disclosed
US-6756383-B2 SUCH AS 3-(2-(METHOXYCARBONYL)ACETYLAMINO)PYRIDINE-4-CARBOXYLIC ACID FOR TREATMENT OF DISEASES CHARACTERIZED BY ACTIVITY OF VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR TYROSINE KINASES; ENZYME INHIBITORS CHIRON CORPORATION 2004-06-29 US disclosed
US-20040002518-A1 Heterocyclic compounds CHIRON CORPORATION 2004-01-01 US disclosed
US-20020103230-A1 Heterocyclic compounds CHIRON CORPORATION 2002-08-01 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 (4 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-20020103230-A1 Heterocyclic compounds SLCO2A1, SLCO1B1, SLCO2B1 FGFR1 1252/4885FLT1 3035/4885PDGFRB 4093/4885
US-20070032528-A1 Heterocyclic compounds SLCO4C1, SLCO2B1, SLCO1B1 FGFR1 560/4885FLT1 2959/4885PDGFRB 2263/4885
US-20050137188-A1 Heterocyclic compounds SLCO4C1, SLCO2B1, SLCO1B1 FGFR1 560/4885FLT1 2959/4885PDGFRB 2263/4885
US-20040002518-A1 Heterocyclic compounds SLCO2A1, SLCO1B1, SLCO2B1 FGFR1 1252/4885FLT1 3035/4885PDGFRB 4093/4885

“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.