SCHEMBL7255647

SCHEMBL7255647

CC1C(=O)C(c2ccc(F)cc2)=C(c2ccccc2)C1(O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.62
CRHR2 Q13324 1/20 0.62
PTGS2 P35354 9/20 0.39
PTGS1 P23219 8/20 0.38
HSD11B1 P28845 1/20 0.32
CYP2D6 P10635 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CCR2 P41597 1/20 0.32
MAPK14 Q16539 1/20 0.31

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
SCHEMBL7257013 0.92 CRHBP (0.72) CRHBPCRHR2PTGS2PTGS1MEN1
SCHEMBL7256885 0.92 CRHBP (0.72) CRHBPCRHR2PTGS2PTGS1MEN1
SCHEMBL7257012 0.92 CRHBP (0.72) CRHBPCRHR2PTGS2PTGS1MEN1
SCHEMBL8017544 0.73 CRHBP (0.50) CRHBPCRHR2PTGS2PTGS1MAPT
SCHEMBL8017540 0.73 CRHBP (0.50) CRHBPCRHR2PTGS2PTGS1MAPT
SCHEMBL8017542 0.73 CRHBP (0.50) CRHBPCRHR2PTGS2PTGS1MAPT
SCHEMBL8023972 0.73 CRHBP (0.50) CRHBPCRHR2PTGS2PTGS1MAPT
SCHEMBL7255719 0.71 CRHBP (0.49) CRHBPCRHR2PTGS2PTGS1MEN1
SCHEMBL7256945 0.70 CRHBP (0.43) CRHBPCRHR2MEN1ALDH1A1MAPT
SCHEMBL13170498 0.69 CRHBP (0.44) CRHBPCRHR2PTGS2PTGS1HSD11B1

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-2003080553-A1 CYCLOPENTENE DERIVATIVES BAYER HEALTHCARE AG (DE) 2003-10-02 WO disclosed