SCHEMBL13352354

SCHEMBL13352354

CNc1cc(OC)cc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 6/20 0.56
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ RAB9A P51151 3/20 0.47
▸ CDC25A P30304 1/20 0.47
▸ CDC25C P30307 1/20 0.47
▸ KMT2A Q03164 6/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ CASP3 P42574 2/20 0.43
▸ SENP7 Q9BQF6 2/20 0.43
▸ APAF1 O14727 1/20 0.43
▸ TDP2 O95551 1/20 0.43
▸ CASP7 P55210 1/20 0.43
▸ CASP9 P55211 1/20 0.43
▸ CASP6 P55212 1/20 0.43
▸ CASP8 Q14790 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43

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
SCHEMBL6536796 0.84 CDC25B (0.55) CDC25BCYP1A2CYP2A6RAB9ACDC25A
SCHEMBL1408380 0.81 CDC25B (0.71) CDC25BRAB9ACDC25ACDC25CALDH1A1
SCHEMBL27937841 0.80 CDC25B (0.40) CDC25BCYP1A2CDC25ACDC25CKMT2A
SCHEMBL30305264 0.78 CDC25B (0.64) CDC25BRAB9ACDC25ACDC25CKMT2A
SCHEMBL29370537 0.75 NQO1 (0.57) CDC25BCYP1A2CYP2A6KMT2AMEN1
SCHEMBL4433796 0.75 CYP2A6 (0.57) CYP1A2CYP2A6RAB9AKMT2AMEN1
SCHEMBL30011882 0.75 CYP1A2 (0.54) CDC25BCYP1A2CYP2A6KMT2AMEN1
SCHEMBL443362 0.75 NQO1 (0.57) CDC25BCYP1A2CYP2A6KMT2AMEN1
SCHEMBL5782272 0.75 CYP1A2 (0.54) CDC25BCYP1A2CYP2A6KMT2AMEN1
SCHEMBL1161428 0.75 CYP2A6 (0.57) CDC25BCYP1A2CYP2A6RAB9AKMT2A

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-2186801-A2 Intermediates for synthesizing dibenzorhodamine dyes Applera Corporation (US) 2010-05-19 — — EP disclosed
Send feedback