SCHEMBL16665285

SCHEMBL16665285

O=C(CCl)Nc1ccccc1Nc1cc(Oc2cccc(Cl)c2)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.49
ALDH1A1 P00352 3/20 0.47
HTT P42858 2/20 0.47
MITF O75030 1/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.47
GCK P35557 1/20 0.45
RNF4 P78317 1/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NOTUM Q6P988 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN9A Q15858 1/20 0.41
ABL1 P00519 1/20 0.41
MAP2K7 O14733 1/20 0.41
MAPK10 P53779 1/20 0.41
BLM P54132 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NOD2 Q9HC29 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL16665343 0.80 P2RX3 (0.52) GCKLMNAL3MBTL1
SCHEMBL16665332 0.75 GRM5 (0.41) GRM5HTTGCKLMNASMN1; SMN2
SCHEMBL16665247 0.74 FGFR4 (0.48) GRM5GCKSCN5ASCN9A
SCHEMBL31703420 0.73 ALDH1A1 (0.56) ALDH1A1HTTMITFPOLBMAPK1
SCHEMBL16665347 0.73 FGFR4 (0.49) GRM5HTTGCKSCN5ASCN9A
SCHEMBL16665334 0.73 GCK (0.54) GCK
SCHEMBL31703396 0.72 RNF4 (0.73) ALDH1A1HTTMITFPOLBMAPK1
SCHEMBL16665298 0.72 FGFR4 (0.46) MAPK1
SCHEMBL16665336 0.71 FGFR4 (0.55)
SCHEMBL16665349 0.70 GRM5 (0.47) GRM5ALDH1A1GCKNOTUMSCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015057963-A1 FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed