SCHEMBL28547458

SCHEMBL28547458

COc1ccc(C2Oc3ccccc3C(=O)C2O)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.59
▸ KDM4E B2RXH2 3/20 0.59
▸ CYP2C19 P33261 3/20 0.59
▸ HTT P42858 3/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ CYP3A4 P08684 2/20 0.59
▸ CYP2D6 P10635 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ HIF1A Q16665 2/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ NPC1 O15118 1/20 0.59
▸ POLB P06746 1/20 0.59
▸ NFKB1 P19838 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ NFKB2 Q00653 1/20 0.59
▸ RELA Q04206 1/20 0.59
▸ LMNA P02545 3/20 0.56
▸ MAPT P10636 2/20 0.56
▸ HPGD P15428 2/20 0.56
▸ AGTR1 P30556 2/20 0.56

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
SCHEMBL29352087 1.00 SMN1; SMN2 (0.59) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL28543921 0.87 LMNA (0.54) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL29101712 0.82 ALDH1A1 (0.69) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL7518815 0.75 SMN1; SMN2 (0.58) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL11111994 0.69 DNMT3B (0.42) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL24115843 0.69 RET (0.77) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL29367518 0.69 RET (0.77) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL3362960 0.69 RET (0.77) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL29843330 0.69 RET (0.77) SMN1; SMN2KDM4ECYP2C19HTTMEN1
SCHEMBL3439134 0.69 RET (0.77) SMN1; SMN2KDM4ECYP2C19HTTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111925427-B Application of rice OsT5H gene as negative regulatory factor in promoting rice thrombosis 浙江大学 2022-01-25 — — CN disclosed
CN-111925427-A Application of rice OsT5H gene as negative regulatory factor in promoting rice thrombosis 浙江大学 2020-11-13 — — CN disclosed
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