SCHEMBL21134100

SCHEMBL21134100

c1ccc(Pc2ccccc2Oc2ccccc2C(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32

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
SCHEMBL166427 0.82 LTA4H (0.32)
SCHEMBL21420998 0.82 IDO1 (0.41) ALDH1A1GAAKMT2ATDP1IDO1
SCHEMBL27660156 0.72 MMP3 (0.38) ALDH1A1KMT2ATDP1IDO1
SCHEMBL3039320 0.69 IDO1 (0.58) ALDH1A1KMT2ATDP1IDO1TDO2
SCHEMBL3670294 0.68 NCOA1 (0.34)
SCHEMBL18053430 0.68 CYP3A4 (0.34) TDP1
SCHEMBL19719371 0.68 HPGD (0.44)
SCHEMBL19646251 0.68 HPGD (0.44)
SCHEMBL4444463 0.67 CA1 (0.50) ALDH1A1GAAKMT2ATDP1
SCHEMBL18011789 0.67 IDO1 (0.39) ALDH1A1GAAKMT2ATDP1IDO1

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-10347851-B2 Highly efficient OLED devices with very short decay times UDC IRELAND LIMITED (IE) 2019-07-09 US disclosed