SCHEMBL11639360

SCHEMBL11639360

C=CCOC(=O)c1c(O)c2cc3c(cc2n(CC=C)c1=O)OCO3

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.53
▸ KMT2A Q03164 8/20 0.53
▸ LMNA P02545 3/20 0.51
▸ KDM4E B2RXH2 4/20 0.48
▸ HPGD P15428 4/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ ALDH1A1 P00352 6/20 0.40
▸ GAA P10253 2/20 0.40
▸ NPC1 O15118 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ USP2 O75604 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL11377719 0.91 LMNA (0.64) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11379801 0.85 KMT2A (0.55) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11642302 0.82 LMNA (0.60) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11641263 0.81 RXFP1 (0.58) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11643317 0.79 LMNA (0.54) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11642218 0.78 LMNA (0.55) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11640249 0.78 LMNA (0.80) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11445264 0.76 KMT2A (0.45) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11377907 0.74 LMNA (0.71) MEN1KMT2ALMNAKDM4EHPGD
SCHEMBL11374384 0.73 LMNA (0.69) MEN1KMT2ALMNAKDM4EHPGD

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
US-4119720-A ANTIALLERGENS SANDOZ, INC. (US) 1978-10-10 — — US claimed
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