SCHEMBL28259686

SCHEMBL28259686

Cc1ccc(/C=C/c2ccc3c(=O)c4ccccc4oc3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 7/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ HPGD P15428 2/20 0.53
▸ GLA P06280 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ PGAM1 P18669 1/20 0.53
▸ CASP1 P29466 1/20 0.53
▸ CASP7 P55210 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ NPC1 O15118 6/20 0.52
▸ RAB9A P51151 6/20 0.52
▸ CASP3 P42574 1/20 0.52
▸ SENP8 Q96LD8 1/20 0.52
▸ SENP7 Q9BQF6 1/20 0.52
▸ SENP6 Q9GZR1 1/20 0.52
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50

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
SCHEMBL28259688 1.00 MAOA (0.53) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28259120 0.85 MAOA (0.58) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28257336 0.85 MAOA (0.69) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28257333 0.85 MAOA (0.69) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28259119 0.85 MAOA (0.58) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL24241564 0.85 MAOA (0.56) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28257447 0.85 MAOA (0.61) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28257467 0.85 MAOA (0.72) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28257448 0.85 MAOA (0.61) MAOAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL28257466 0.85 MAOA (0.72) MAOAALDH1A1SMN1; SMN2KDM4EMAPT

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
CN-108864058-A A kind of xanthone fluorochrome and application 成都必凯科技有限公司 2018-11-23 — — CN disclosed
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