SCHEMBL9853557

SCHEMBL9853557

CSc1ccc(Oc2cccc(C=CC(C)=O)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.42
MAPT P10636 4/20 0.42
KDM4E B2RXH2 4/20 0.42
CYP1A2 P05177 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
CYP2C19 P33261 2/20 0.42
HTT P42858 2/20 0.42
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
NPC1 O15118 2/20 0.36
NFKB1 P19838 2/20 0.36
RAB9A P51151 2/20 0.36
NFKB2 Q00653 2/20 0.36
RELA Q04206 2/20 0.36
PKM P14618 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36

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
SCHEMBL9853554 1.00 LMNA (0.42) LMNAMAPTKDM4ECYP1A2SMN1; SMN2
SCHEMBL9853478 0.81 TERT (0.46) MAPTKDM4ECYP1A2HTTKMT2A
SCHEMBL4584462 0.76 KDM4E (0.51) LMNAMAPTKDM4ECYP1A2SMN1; SMN2
SCHEMBL4584461 0.76 KDM4E (0.51) LMNAMAPTKDM4ECYP1A2SMN1; SMN2
SCHEMBL29002664 0.75 GLA (0.46) LMNAMAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL9868747 0.74 KDM4E (0.46) MAPTKDM4EF2F10PRSS1
SCHEMBL9853516 0.72 MAPT (0.56) LMNAMAPTCYP1A2SMN1; SMN2CYP2C19
SCHEMBL10648968 0.72 KDM4E (0.42) LMNAMAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL9986917 0.70 F2 (0.39) HTTKMT2AMEN1F2F10
SCHEMBL12070369 0.70 F2 (0.39) MAPTCYP1A2HTTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991015476-A1 SUBSTITUTED CYCLOHEXANEDIONES AND THEIR HERBICIDAL USES DOWELANCO (US) 1991-10-17 WO disclosed
EP-0450712-A2 Substituted cyclohexanediones and their herbicidal uses DOWELANCO (US) 1991-10-09 EP disclosed
US-5013352-A Grassy weeds in presence of crops DOWELANCO (US) 1991-05-07 US disclosed