SCHEMBL13869348

SCHEMBL13869348

Cc1ccc2c(-c3cc4c(ccc5cc(C(C)(C)C)ccc54)oc3=O)c(C)ccc2c1-c1cc2c(ccc3cc(C(C)(C)C)ccc32)oc1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.38
▸ KDM4E B2RXH2 8/20 0.38
▸ MAPT P10636 7/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ POLB P06746 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ PON1 P27169 1/20 0.38
▸ ADAM17 P78536 1/20 0.37
▸ HPGD P15428 2/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ THRB P10828 1/20 0.35

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
SCHEMBL13869378 0.89 KDM4E (0.45) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869617 0.88 KDM4E (0.44) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869270 0.84 MAOB (0.44) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869313 0.83 ALDH1A1 (0.44) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869636 0.82 MAOB (0.46) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869432 0.82 PON1 (0.39) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869363 0.82 KDM4E (0.55) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869512 0.81 MAPT (0.43) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869238 0.81 MAPT (0.51) ALDH1A1KDM4EMAPTMEN1POLB
SCHEMBL13869288 0.80 MAPT (0.53) ALDH1A1KDM4EMAPTMEN1POLB

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-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 — — US disclosed
US-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 — — US disclosed
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