SCHEMBL11873585

SCHEMBL11873585

O=c1c(CO)coc2cc3c(cc12)CCCC3

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.53
▸ LMNA P02545 6/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ KDM4E B2RXH2 5/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ ADRB2 P07550 1/20 0.39
▸ POLB P06746 3/20 0.38
▸ RECQL P46063 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TSHR P16473 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ ESR1 P03372 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CTDSP1 Q9GZU7 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
SCHEMBL11869359 0.73 MAOB (0.68) MAOBKDM4ESMN1; SMN2MAPTPOLB
SCHEMBL11865039 0.73 PTPN1 (0.54) MAOBLMNAKMT2AMEN1HPGD
SCHEMBL11393281 0.72 LMNA (0.41) LMNAKMT2AMEN1HPGDKDM4E
SCHEMBL20588726 0.72 LMNA (0.64) LMNAKMT2AMEN1HPGDKDM4E
SCHEMBL11862946 0.72 NQO1 (0.46) MAOBHPGDKDM4ESMN1; SMN2MAPT
SCHEMBL11398826 0.72 LMNA (0.47) MAOBLMNAKMT2AMEN1HPGD
SCHEMBL21591575 0.71 MAOB (0.65) MAOBLMNAKMT2AMEN1HPGD
SCHEMBL11617058 0.71 MAOB (0.65) MAOBLMNAHPGDKDM4ESMN1; SMN2
SCHEMBL21591578 0.70 MAOB (0.63) MAOBLMNAKMT2AHPGDKDM4E
SCHEMBL11624553 0.70 MAOB (0.63) MAOBKMT2AMEN1SMN1; SMN2MAPT

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-3959480-A Polycyclic gamma-pyrone-3-carboxaldehyde derivatives WARNER-LAMBERT COMPANY (US) 1976-05-25 — — US disclosed
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