SCHEMBL28567451

SCHEMBL28567451

CC(C)Sc1c(-c2ccccc2)oc2ccccc2c1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 3/20 0.56
▸ KDM4E B2RXH2 6/20 0.55
▸ CYP3A4 P08684 6/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ MEN1 O00255 4/20 0.55
▸ LMNA P02545 3/20 0.55
▸ TP53 P04637 2/20 0.55
▸ ALOX15 P16050 2/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ CA1 P00915 2/20 0.55
▸ CA2 P00918 2/20 0.55
▸ DDR2 Q16832 1/20 0.55
▸ CA12 O43570 1/20 0.55
▸ ABCB1 P08183 1/20 0.55
▸ CALM1 P0DP23 1/20 0.55
▸ AR P10275 1/20 0.55
▸ PKM P14618 1/20 0.55
▸ CYP1B1 Q16678 1/20 0.55
▸ CA9 Q16790 1/20 0.55
▸ ADORA3 P0DMS8 1/20 0.55

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
SCHEMBL7827471 0.83 ABCG2 (0.60) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL26661233 0.80 KMT2A (0.64) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL10929648 0.78 ADORA3 (0.60) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL28389346 0.77 ABCG2 (0.60) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL28381234 0.75 KMT2A (0.57) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL30558214 0.75 ABCG2 (0.70) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL18932159 0.75 ABCG2 (0.70) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL18079037 0.75 DDR2 (0.60) ABCG2KDM4ECYP3A4KMT2AMEN1
SCHEMBL4634295 0.74 ABCG2 (0.66) ABCG2KDM4ECYP3A4KMT2AMEN1
3-Methyl-2-Phenyl-4H-Chromen-4-One SCHEMBL694139 0.74 ALDH1A1 (0.68) ABCG2KDM4ECYP3A4KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112807246-B Ultraviolet-curing optically variable nail polish and preparation method thereof 万华化学集团股份有限公司(CN) 2023-01-13 — — CN claimed
CN-112807246-A Ultraviolet-curing optically variable nail polish and preparation method thereof 万华化学集团股份有限公司 2021-05-18 — — CN claimed
CN-112807246-B Ultraviolet-curing optically variable nail polish and preparation method thereof 万华化学集团股份有限公司(CN) 2023-01-13 — — CN disclosed
CN-112807246-A Ultraviolet-curing optically variable nail polish and preparation method thereof 万华化学集团股份有限公司 2021-05-18 — — CN disclosed
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