SCHEMBL27599683

SCHEMBL27599683

CCCCC=Cc1c(O)c2c(OCC(O)CO)cccc2oc1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ NQO1 P15559 1/20 0.38
▸ CYP1A2 P05177 3/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ AGTR1 P30556 1/20 0.37
▸ ADRB2 P07550 4/20 0.36
▸ NMT2 O60551 2/20 0.36
▸ ADRB1 P08588 2/20 0.36
▸ ADRB3 P13945 2/20 0.36
▸ NMT1 P30419 2/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ATM Q13315 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
SCHEMBL27599655 0.87 POLM (0.36) NQO1FAAH
SCHEMBL27599593 0.85 CYP1A2 (0.40) LMNAMEN1KMT2ACYP1A2KDM4E
SCHEMBL6270583 0.85 GPR35 (0.38) GPR35LMNATDP1MEN1KMT2A
SCHEMBL6270586 0.85 GPR35 (0.38) GPR35LMNATDP1MEN1KMT2A
SCHEMBL27582302 0.82 NQO1 (0.39) LMNAMEN1KMT2ANQO1NMT2
SCHEMBL27599606 0.82 NQO1 (0.39) LMNAMEN1KMT2ANQO1FAAH
SCHEMBL6271437 0.81 GPR35 (0.42) GPR35LMNATDP1MEN1KMT2A
SCHEMBL27599595 0.80 ALK (0.39) NQO1TOP2A
SCHEMBL27582308 0.80 ALDH2 (0.43) MEN1KMT2ANQO1KDM4EALDH1A1
SCHEMBL6270379 0.79 GPR35 (0.41) GPR35LMNATDP1MEN1KMT2A

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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