SCHEMBL9709038

SCHEMBL9709038

CCN(Cc1ccccc1)c1cc(OC)c(OC)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.59
DHFR P00374 1/20 0.49
MAPK1 P28482 2/20 0.49
CNR2 P34972 2/20 0.47
CNR1 P21554 1/20 0.47
CASR P41180 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CETP P11597 1/20 0.45
PTGS2 P35354 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL11544567 0.84 TSHR (0.59) TSHRDHFRMAPK1CNR2CNR1
SCHEMBL9708987 0.81 POLB (0.51) TSHRDHFRMAPK1L3MBTL1POLB
SCHEMBL11684683 0.79 TSHR (0.51) TSHRMAPK1CNR2CNR1L3MBTL1
SCHEMBL22340711 0.79 TSHR (0.70) TSHRMAPK1CNR2CNR1ALDH1A1
SCHEMBL11131644 0.78 TSHR (0.64) TSHRMAPK1CNR2CNR1CETP
SCHEMBL7324260 0.77 TSHR (0.49) TSHRMAPK1CNR2CNR1POLB
SCHEMBL11469036 0.76 TSHR (0.51) TSHRMAPK1CNR2CNR1L3MBTL1
SCHEMBL22340783 0.76 TSHR (0.70) TSHRMAPK1CNR2CNR1ALDH1A1
SCHEMBL15720901 0.76 KDM4E (0.73) MAPK1L3MBTL1POLBSMN1; SMN2ALDH1A1
SCHEMBL8351297 0.76 DHFR (0.43) DHFRSMN1; SMN2ALDH1A1MEN1KMT2A

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-0515684-A1 INHIBITOR OF DENATURED LDL FORMATION Chugai Seiyaku Kabushiki Kaisha (JP) 1992-12-02 EP disclosed