SCHEMBL11740944

SCHEMBL11740944

Cc1ccc(Cc2ccc(Oc3ccc(Cc4ccc(C)cc4C)cc3)cc2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
KCNH2 Q12809 1/20 0.40
TEAD4 Q15561 1/20 0.39
IDH1 O75874 1/20 0.39
ALDH1A1 P00352 4/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ST14 Q9Y5Y6 1/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
CNR2 P34972 1/20 0.37
PYCR1 P32322 1/20 0.37
SRD5A2 P31213 1/20 0.36

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
SCHEMBL20204976 0.98 TEAD4 (0.42) HTR2ASLC6A4KCNH2TEAD4IDH1
SCHEMBL28302613 0.87 L3MBTL1 (0.50) IDH1ALDH1A1TDP1L3MBTL1CNR2
SCHEMBL4624112 0.86 PYCR1 (0.42) ALDH1A1TDP1KDM4ESMN1; SMN2CNR2
SCHEMBL17771266 0.82 PDE3B (0.40) HTR2ASLC6A4KCNH2ALDH1A1KDM4E
SCHEMBL1539299 0.80 ACHE (0.48) MAPTL3MBTL1CNR2
SCHEMBL14407100 0.79 PYCR1 (0.38) ALDH1A1TDP1KDM4EPYCR1
SCHEMBL10950441 0.79 MAP2K4 (0.41) ALDH1A1TDP1KDM4EPYCR1
SCHEMBL7566966 0.79 ESR1 (0.48) IDH1ALDH1A1POLBMAPTTDP1
SCHEMBL7952150 0.79 L3MBTL1 (0.35) ALDH1A1KDM4EL3MBTL1
SCHEMBL9234531 0.79 LTA4H (0.49) HTR2ASLC6A4IDH1MAPTSRD5A2

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
US-4042603-A SUBSTITUTED DIBENZOFURAN OR 9-FLUORENONE FROM A DIPHENYL ETHER OR BENZOPHENONE UBE INDUSTRIES, LTD. (JA) 1977-08-16 US disclosed