SCHEMBL3056468

SCHEMBL3056468

CN1CCN(C2CCN(C(=O)Nc3cc(Oc4ccc(NC(=O)C5(C(=O)O)CC5)c(F)c4)ccn3)CC2)CC1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.84
MET P08581 4/20 0.84
MAPK14 Q16539 3/20 0.84
NTRK1 P04629 2/20 0.84
EPHB6 O15197 1/20 0.84
RIPK2 O43353 1/20 0.84
ABL1 P00519 1/20 0.84
LCK P06239 1/20 0.84
LYN P07948 1/20 0.84
RET P07949 1/20 0.84
HCK P08631 1/20 0.84
PDGFRB P09619 1/20 0.84
BCR P11274 1/20 0.84
EPHA2 P29317 1/20 0.84
EPHB2 P29323 1/20 0.84
FLT3 P36888 1/20 0.84
ABL2 P42684 1/20 0.84
FRK P42685 1/20 0.84
LIMK1 P53667 1/20 0.84
EPHB3 P54753 1/20 0.84

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
Hydrochloric Acid SCHEMBL3061945 0.99 KDR (0.82) KDRMETMAPK14NTRK1EPHB6
Hydrochloric Acid SCHEMBL15452974 0.98 KDR (0.81) KDRMETMAPK14NTRK1EPHB6
SCHEMBL2250781 0.93 KDR (0.89) KDRMETMAPK14NTRK1EPHB6
Golvatinib SCHEMBL30498607 0.91 MET (1.00) KDRMETMAPK14NTRK1EPHB6
Golvatinib SCHEMBL30498608 0.91 MET (1.00) KDRMETMAPK14NTRK1EPHB6
Golvatinib SCHEMBL1727298 0.91 MET (1.00) KDRMETMAPK14NTRK1EPHB6
Golvatinib SCHEMBL4249254 0.90 MET (0.99) KDRMETMAPK14NTRK1EPHB6
Golvatinib SCHEMBL1727167 0.90 MET (0.99) KDRMETMAPK14NTRK1EPHB6
SCHEMBL14945014 0.90 KDR (0.90) KDRMETMAPK14NTRK1EPHB6
Golvatinib SCHEMBL1728754 0.89 MET (0.92) KDRMETMAPK14NTRK1EPHB6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759530-B2 Method for producing phenoxypyridine derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2014-06-24 US disclosed
US-20140011999-A1 Method for Producing Phenoxypyridine Derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2014-01-09 US disclosed
EP-2058302-B1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2013-04-17 EP disclosed
US-8377938-B2 Phenoxypyridine derivative salts and crystals thereof, and process for preparing the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-02-19 US disclosed
US-7790885-B2 Process for preparing phenoxypyridine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-09-07 US disclosed
US-7790885-B2 Process for preparing phenoxypyridine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-09-07 US disclosed
US-7790885-B2 Process for preparing phenoxypyridine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-09-07 US disclosed
EP-2058302-A1 METHOD FOR PRODUCING PHENOXYPYRIDINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2009-05-13 EP disclosed
US-20080318924-A1 PHENOXYPYRIDINE DERIVATIVE SALTS AND CRYSTALS THEREOF, AND PROCESS FOR PREPARING THE SAME EISAI R&D MANAGEMENT CO., LTD (JP) 2008-12-25 US disclosed
US-20080214815-A1 Process for preparing phenoxypyridine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-09-04 US disclosed
US-20080214815-A1 Process for preparing phenoxypyridine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-09-04 US disclosed
US-20080214815-A1 Process for preparing phenoxypyridine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-09-04 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-20140011999-A1 Method for Producing Phenoxypyridine Derivative QDPR, DRD4, DOT1L KDR 1936/4885MET 263/4885MAPK14 1284/4885
US-20080318924-A1 PHENOXYPYRIDINE DERIVATIVE SALTS AND CRYSTALS THEREOF, AND PROCESS FOR PREPARING THE SAME HGF, MET, FLT1 KDR 9/4885MET 2/4885MAPK14 946/4885
US-20080214815-A1 Process for preparing phenoxypyridine derivatives FIP1L1, SKP1, TET2 KDR 1759/4885MET 1938/4885MAPK14 2109/4885

“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.