SCHEMBL3383444

SCHEMBL3383444

CC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 8/20 0.55
LMNA P02545 3/20 0.54
KMT2A Q03164 4/20 0.52
ALDH1A1 P00352 4/20 0.52
MEN1 O00255 2/20 0.52
ESR1 P03372 1/20 0.52
POLB P06746 1/20 0.52
ALOX15 P16050 1/20 0.52
HTT P42858 1/20 0.52
HSD17B10 Q99714 1/20 0.52
NPC1 O15118 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
HPGD P15428 1/20 0.49
CYP2C19 P33261 1/20 0.49
RAB9A P51151 1/20 0.48
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL3383409 0.83 KCNJ6 (0.60) ANO1KMT2AMEN1SMN1; SMN2GAA
SCHEMBL16046822 0.77 KMT2A (0.61) LMNAKMT2AALDH1A1MEN1ALOX15
SCHEMBL27705871 0.75 ANO1 (0.50) ANO1LMNAHTTSMN1; SMN2
SCHEMBL3195230 0.75 ANO1 (0.46) ANO1LMNAKMT2AMEN1HTT
SCHEMBL14720058 0.75 P2RX7 (0.51) POLBNPC1CYP2C19MAPT
SCHEMBL16045905 0.73 RET (0.58) LMNAKMT2AALDH1A1MEN1RAB9A
SCHEMBL8444 0.73 DGAT1 (0.46) KMT2AMEN1HSD17B10CYP1A2MAPK1
SCHEMBL16046621 0.73 RET (0.47) KMT2AALDH1A1MEN1CYP1A2CYP2D6
SCHEMBL19976712 0.72 KMT2A (0.63) LMNAKMT2AALDH1A1MEN1ESR1
SCHEMBL5820518 0.72 L3MBTL1 (0.73) LMNAKMT2AALDH1A1MEN1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101128461-B Imidazo (1, 2-a) pyridine compounds as VEGF-R2 inhibitors LILLY CO ELI 2010-12-22 CN disclosed
EP-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed
CN-101128461-A Imidazo (1, 2-a) pyridine compounds as VEGF-R2 inhibitors LILLY CO ELI (US) 2008-02-20 CN disclosed