SCHEMBL8801824

SCHEMBL8801824

CCC(O)c1c(C)oc2c(NC(=O)c3c(Cl)ccc(NC(=O)CN(C)C)c3Cl)cccc12

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 8/20 0.35
PARP14 Q460N5 1/20 0.34
GPR35 Q9HC97 1/20 0.33
TACR3 P29371 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PIK3CD O00329 1/20 0.31
PIK3R1 P27986 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
THRB P10828 1/20 0.31
MAPT P10636 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
SCHEMBL7827494 0.86 PARP14 (0.37) GHSRPARP14GPR35MEN1KMT2A
SCHEMBL7831900 0.85 MAPT (0.40) GHSRPARP14GPR35MEN1KMT2A
SCHEMBL8800035 0.84 GHSR (0.40) GHSRMEN1KMT2ATHRBMAPT
SCHEMBL7828389 0.82 PARP14 (0.35) GHSRPARP14GPR35MEN1KMT2A
SCHEMBL8800451 0.81 TYK2 (0.42) GHSRMEN1KMT2AL3MBTL1MAPT
SCHEMBL8801121 0.80 GPR35 (0.39) GHSRGPR35MEN1KMT2ATHRB
SCHEMBL8799666 0.79 GHSR (0.42) GHSRMEN1KMT2AL3MBTL1MAPT
SCHEMBL8799385 0.79 GHSR (0.38) GHSRTHRB
SCHEMBL7826683 0.78 MAPT (0.43) PARP14MEN1KMT2ATHRBMAPT
SCHEMBL7816603 0.77 MEN1 (0.38) GHSRMEN1KMT2ATHRBMAPT

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-0757682-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed