SCHEMBL16655970

SCHEMBL16655970

CCCCCCCCCCCCCCCC(=O)Nc1cc(OC)cc(OC)c1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
TRPV1 Q8NER1 2/20 0.48
CNR1 P21554 1/20 0.48
KDM4E B2RXH2 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
ACAT1 P24752 1/20 0.48
SOAT1 P35610 1/20 0.48
HDAC4 P56524 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PAK1 Q13153 1/20 0.47
POLB P06746 1/20 0.46

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
SCHEMBL9499542 0.82 KDM4E (0.64) GAATDP1L3MBTL1CNR1KDM4E
SCHEMBL9498007 0.82 KDM4E (0.64) GAATDP1L3MBTL1CNR1KDM4E
SCHEMBL9498652 0.82 KDM4E (0.64) GAATDP1L3MBTL1CNR1KDM4E
SCHEMBL9497942 0.82 KDM4E (0.64) GAATDP1L3MBTL1CNR1KDM4E
SCHEMBL17817424 0.82 GAA (0.76) GAATDP1L3MBTL1KDM4ECYP3A4
SCHEMBL8708567 0.82 ALDH1A1 (0.69) GAATDP1L3MBTL1TP53MAPT
SCHEMBL8368156 0.82 GAA (0.76) GAATDP1L3MBTL1KDM4ECYP3A4
SCHEMBL10683818 0.76 MAPT (0.59) GAATDP1L3MBTL1KDM4ETP53
SCHEMBL374670 0.76 HSD17B1 (0.48) GAAKDM4ECYP3A4MAPTTSHR
SCHEMBL3976468 0.76 CYP1A1 (0.44) GAATDP1KDM4ETP53MAPT

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 2 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-2015057938-A1 PYRIMIDINE FGFR4 INHIBITORS EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-23 WO disclosed