SCHEMBL8028626

SCHEMBL8028626

COC(=O)C1=C(C)Cc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.44
FGFR2 P21802 2/20 0.44
FGFR4 P22455 2/20 0.44
FGFR3 P22607 2/20 0.44
SRC P12931 1/20 0.44
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALOX15 P16050 1/20 0.42
TSHR P16473 3/20 0.42
LMNA P02545 1/20 0.42
CA12 O43570 1/20 0.40
CA1 P00915 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
SCHEMBL11099181 0.85 ALDH1A1 (0.52) FGFR1FGFR2FGFR4FGFR3SRC
SCHEMBL11821428 0.82 MAOA (0.43) ALDH1A1KDM4ENPC1RAB9AMEN1
SCHEMBL28800092 0.81 FGFR1 (0.46) FGFR1FGFR2FGFR4FGFR3SRC
SCHEMBL6654078 0.78 ALDH1A1 (0.52) FGFR1FGFR2FGFR4FGFR3SRC
SCHEMBL10956402 0.77 SRD5A2 (0.41) ALDH1A1KDM4EHPGDNPC1RAB9A
SCHEMBL1821797 0.76 FGFR1 (0.39) FGFR1FGFR2FGFR4FGFR3SRC
SCHEMBL20444060 0.76 HSD11B1 (0.50) ALDH1A1KDM4EHPGDL3MBTL1NPC1
SCHEMBL12401719 0.76 KDM4E (0.47) ALDH1A1KDM4EHPGDL3MBTL1NPC1
SCHEMBL18294846 0.75 LOXL2 (0.44) ALDH1A1KDM4EHPGDL3MBTL1RAB9A
Fluorene SCHEMBL2708609 0.74 TSHR (0.68) ALDH1A1KDM4EHPGDL3MBTL1NPC1

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
EP-0976709-A1 2,3-DISUBSTITUTED CYCLOPENTANONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL USE THEREOF NIPPON KAYAKU CO., LTD. (JP) 2000-02-02 EP disclosed