SCHEMBL16655482

SCHEMBL16655482

CCO/C(=C(/OC)C(N)=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.44
NPC1 O15118 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
RAB9A P51151 2/20 0.43
GAA P10253 2/20 0.43
TSHR P16473 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.41
ADORA3 P0DMS8 1/20 0.40

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
SCHEMBL16655484 0.87 SMN1; SMN2 (0.46) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL7675491 0.84 TSHR (0.50) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL18812998 0.80 KMT2A (0.49) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL4592985 0.79 SMN1; SMN2 (0.54) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL27528805 0.78 ALDH1A1 (0.56) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL9359702 0.75 MEN1 (0.46) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL9359710 0.75 MEN1 (0.46) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL27879907 0.74 KMT2A (0.48) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1
SCHEMBL8380441 0.74 HPGD (0.49) SMN1; SMN2KMT2ANPC1ALDH1A1MAPT
SCHEMBL4739425 0.74 KMT2A (0.50) SMN1; SMN2KMT2AMEN1NPC1ALDH1A1

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
EP-3057943-A1 PYRIMIDINE FGFR4 INHIBITORS Eisai R&D Management Co., Ltd. (JP) 2016-08-24 EP disclosed
WO-2015057963-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed
WO-2015057938-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed