SCHEMBL27989486

SCHEMBL27989486

CCCc1cccc(C(=O)OI)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 3/20 0.55
▸ CYP4A11 Q02928 3/20 0.55
▸ LOXL2 Q9Y4K0 1/20 0.49
▸ KAT6A Q92794 2/20 0.47
▸ ALOX5 P09917 1/20 0.46
▸ SLC7A5 Q01650 2/20 0.42
▸ MEP1B Q16820 1/20 0.41
▸ MRGPRX4 Q96LA9 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAP1LC3B Q9GZQ8 1/20 0.40
▸ MAP1LC3A Q9H492 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL27953652 0.88 LOXL2 (0.53) CYP4F2CYP4A11LOXL2KAT6ASLC7A5
SCHEMBL28398121 0.86 CYP4F2 (0.58) CYP4F2CYP4A11LOXL2KAT6AALOX5
SCHEMBL1696378 0.85 CYP4F2 (0.76) CYP4F2CYP4A11LOXL2KAT6ASLC7A5
SCHEMBL27986137 0.83 CYP4F2 (0.55) CYP4F2CYP4A11LOXL2KAT6AALOX5
SCHEMBL12035616 0.83 CYP4F2 (0.75) CYP4F2CYP4A11MEP1BMAPTSMN1; SMN2
SCHEMBL15344632 0.82 LMNA (0.62) CYP4F2CYP4A11LOXL2SLC7A5MAPT
SCHEMBL5382573 0.81 SLC7A5 (0.60) CYP4F2CYP4A11LOXL2KAT6AALOX5
SCHEMBL11752450 0.80 KAT6A (0.52) CYP4F2CYP4A11LOXL2KAT6AALOX5
SCHEMBL15344564 0.80 CYP4F2 (0.61) CYP4F2CYP4A11SMN1; SMN2ALDH1A1HPGD
SCHEMBL991080 0.79 FOLH1 (0.61) KAT6AMRGPRX4TP53PKMNFKB1

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-102351791-B Cyanoisoquinoline compounds capable of making hypoxia inducible factor (HIF) stable FIBROGEN INC. (US) 2014-10-29 — — CN disclosed
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