SCHEMBL11526876

SCHEMBL11526876

OCC1c2ccccc2C(CO)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 7/20 0.40
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
HRH1 P35367 2/20 0.36
RET P07949 1/20 0.36
HTR2C P28335 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
TDO2 P48775 1/20 0.33

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
SCHEMBL11526446 0.87 HTR2A (0.33) HTR2AMEN1GAAKMT2AHRH1
SCHEMBL29639019 0.86 HTR2A (0.58) HTR2ATSHRKMT2AHRH3TDO2
SCHEMBL261028 0.86 HTR2A (0.58) HTR2ATSHRKMT2AHRH3TDO2
SCHEMBL9205280 0.82 HTR2A (0.61) HTR2AMEN1GAAKMT2AHRH1
SCHEMBL8820720 0.80 MAOA (0.58) TSHRMEN1KMT2AMAOAMAOB
SCHEMBL22304661 0.80 EGFR (0.49) GAATDO2
SCHEMBL29798222 0.80 MAOA (0.58) TSHRMEN1KMT2AMAOAMAOB
SCHEMBL31410667 0.80 MAOA (0.58) TSHRMEN1KMT2AMAOAMAOB
SCHEMBL9632433 0.80 HTR2A (0.63) HTR2AHRH1RETHTR2C
SCHEMBL9875531 0.80 HTR2A (0.63) HTR2AHRH1RETHTR2C

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-4152356-A SELECTIVE CARBONYLATION OF 9,10-DIHYDROANTHRACENE TO FORM 9-FORMYL-9,10-DIHYDROANTHRACENE EXXON RESEARCH & ENGINEERING CO. (US) 1979-05-01 US disclosed