SCHEMBL27599596

SCHEMBL27599596

CC=Cc1c(O)c2c(OCCC(O)CO)cccc2oc1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NQO1 P15559 2/20 0.40
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PABPC1 P11940 1/20 0.35
▸ GPR35 Q9HC97 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ HIF1A Q16665 1/20 0.34
▸ SENP7 Q9BQF6 3/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ PKM P14618 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ CYP2A6 P11509 1/20 0.32

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
SCHEMBL27599751 0.85 NQO1 (0.44) NQO1MEN1KMT2ATDP1MAPT
SCHEMBL27599655 0.85 POLM (0.36) NQO1
SCHEMBL27599601 0.84 MEN1 (0.35) MEN1KMT2AMAPTKDM4ESENP7
SCHEMBL6276860 0.83 NQO1 (0.39) NQO1MEN1KMT2ATDP1GPR35
SCHEMBL6276864 0.83 NQO1 (0.39) NQO1MEN1KMT2ATDP1GPR35
SCHEMBL6270518 0.81 NQO1 (0.48) NQO1MEN1KMT2ATDP1MAPT
SCHEMBL6276932 0.81 NQO1 (0.42) NQO1MEN1KMT2ATDP1MAPT
SCHEMBL27599687 0.78 NQO1 (0.41) NQO1MAPTKDM4ESENP7ALDH1A1
SCHEMBL27599527 0.78 NQO1 (0.41) NQO1MEN1KMT2AMAPTLMNA
SCHEMBL6274672 0.77 ALOX5 (0.40) NQO1

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-1473565-A Benzopyrany/derivatives and antiallergic agent ���ձ���ī��ѧ��ʽ���� 2004-02-11 — — CN disclosed
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