SCHEMBL28295525

SCHEMBL28295525

COc1ccc(-c2nc(C)c(CO)s2)cc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.60
PTGDR2 Q9Y5Y4 6/20 0.55
MAPT P10636 7/20 0.53
TP53 P04637 4/20 0.53
LMNA P02545 3/20 0.53
THRB P10828 1/20 0.49
PRMT1 Q99873 1/20 0.48

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
SCHEMBL8989130 0.83 KDM4E (0.54) ALOX5MAPTTP53LMNATHRB
SCHEMBL3372237 0.82 MAPT (0.55) PTGDR2MAPTTP53LMNA
SCHEMBL10993434 0.81 PTGDR2 (0.59) ALOX5PTGDR2MAPTTP53LMNA
SCHEMBL3082591 0.81 PPARD (0.45) ALOX5MAPTTP53
SCHEMBL95917 0.81 RAB9A (0.56) ALOX5PTGDR2MAPTTP53LMNA
SCHEMBL4474091 0.81 LMNA (0.48) ALOX5PTGDR2MAPTTP53LMNA
SCHEMBL3077683 0.80 SMN1; SMN2 (0.56) PTGDR2MAPTTP53LMNATHRB
SCHEMBL3772061 0.80 PTGDR2 (0.53) ALOX5PTGDR2MAPTTP53LMNA
SCHEMBL3436700 0.79 CYP1A1 (0.51) MAPTTP53LMNA
SCHEMBL10998817 0.78 MAPT (0.56) ALOX5PTGDR2MAPTTP53LMNA

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-109810071-A A kind of miRNA biosynthesis inhibitor 中国科学院成都生物研究所 2019-05-28 CN disclosed