SCHEMBL7128863

SCHEMBL7128863

O=C(Nc1ccccc1Oc1ccccc1)c1cccnc1NCc1ccncc1

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDR P35968 16/20 0.74
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TSHR P16473 1/20 0.51
ABCB1 P08183 1/20 0.51
FLT1 P17948 1/20 0.49

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 SCHEMBL446385 0.99 KDR (0.73) KDRTDP1L3MBTL1TSHRABCB1
SCHEMBL429097 0.85 KDR (1.00) KDRABCB1FLT1
SCHEMBL429582 0.84 KDR (1.00) KDRABCB1FLT1
Hydrochloric Acid SCHEMBL448754 0.84 KDR (0.98) KDRABCB1FLT1
Hydrochloric Acid SCHEMBL449654 0.84 KDR (0.98) KDRABCB1FLT1
SCHEMBL3151267 0.82 KDR (0.64) KDR
SCHEMBL7128428 0.80 KDR (0.63) KDRABCB1FLT1
SCHEMBL446392 0.79 KDR (0.66) KDRABCB1FLT1
Hydrochloric Acid SCHEMBL444751 0.79 KDR (0.62) KDRABCB1FLT1
SCHEMBL447047 0.78 KDR (0.73) KDRFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358184-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2003-11-05 EP claimed
WO-2002066470-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2002-08-29 WO claimed
EP-1358184-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE Amgen Inc. (US) 2003-11-05 EP disclosed
WO-2002066470-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2002-08-29 WO disclosed