SCHEMBL11228286

SCHEMBL11228286

CC1=Cc2ccc(N(C)C)cc2OC12C=Cc1ccccc1O2

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
P2RX4 Q99571 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
UBE2N P61088 1/20 0.31
KMT2A Q03164 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
SCHEMBL11586208 0.88 CA12 (0.35) HTR2CHTR2BALDH1A1CYP3A4HPGD
SCHEMBL8685175 0.85 HTR2C (0.42) HTR2CHTR2BHSD17B10TDP1MEN1
SCHEMBL9333313 0.84 HTR2C (0.32) HTR2CHTR2BP2RX4
SCHEMBL11586220 0.81 HTR2C (0.38) HTR2CHTR2BP2RX4ALDH1A1CYP3A4
SCHEMBL11233878 0.80 ALDH1A1 (0.30) ALDH1A1CYP3A4HPGDHIF1AHSD17B10
SCHEMBL11237452 0.80 HTR2C (0.47) HTR2CHTR2BALDH1A1CYP3A4HPGD
SCHEMBL10849196 0.75 CA12 (0.33) HTR2CHTR2B
SCHEMBL11259985 0.74 CA12 (0.33) ALDH1A1MEN1MAPTKMT2A
SCHEMBL11264128 0.74 CA12 (0.33) ALDH1A1MEN1MAPTKMT2A
SCHEMBL11392410 0.74 LMNA (0.35) ALDH1A1HPGDHSD17B10TDP1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4346186-A ULTRAVIOLET IRRADIATION ARMSTRONG WORLD INDUSTRIES, INC. (US) 1982-08-24 US disclosed
US-4342696-A PRECURSORS OF COLORED PYRYLIUM SALTS ARMSTRONG WORLD INDUSTRIES, INC. (US) 1982-08-03 US disclosed