SCHEMBL10929274

SCHEMBL10929274

Cc1c(-c2ccccc2)oc2ccccc2c1=S

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 4/20 0.49
▸ KDM4E B2RXH2 7/20 0.47
▸ CYP3A4 P08684 4/20 0.47
▸ LMNA P02545 3/20 0.47
▸ TP53 P04637 3/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ CA12 O43570 2/20 0.47
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ ABCB1 P08183 2/20 0.47
▸ AR P10275 2/20 0.47
▸ CYP1B1 Q16678 2/20 0.47
▸ CA9 Q16790 2/20 0.47
▸ ADORA3 P0DMS8 2/20 0.47
▸ DDR2 Q16832 1/20 0.47
▸ CALM1 P0DP23 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ MAPK1 P28482 1/20 0.47

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
SCHEMBL29839908 0.85 ABCG2 (0.54) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL2620726 0.85 ABCG2 (0.54) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL26661232 0.79 KDM4E (0.65) ABCG2KDM4ECYP3A4LMNATP53
3-Methyl-2-Phenyl-4H-Chromen-4-One SCHEMBL694139 0.79 ALDH1A1 (0.68) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL28567447 0.78 ABCG2 (0.45) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL10929651 0.75 ADORA3 (0.47) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL29839875 0.74 LMNA (0.61) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL29839889 0.74 LMNA (0.61) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL28887973 0.74 CYP3A4 (0.40) ABCG2KDM4ECYP3A4LMNATP53
SCHEMBL28381233 0.72 KMT2A (0.49) ABCG2KDM4ECYP3A4LMNATP53

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
JP-60023379-A — — None — — JP disclosed
JP-S6023379-A NOVEL METHYLTHIOFLAVONE COMPOUND SUBSTITUTED AT 3-POSITION AND ITS PREPARATION SHIN NIPPON YAKUHIN KK 1985-02-05 — — JP disclosed
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