SCHEMBL9683905

SCHEMBL9683905

CCOC(=O)c1c(N)cccc1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.55
HSD17B10 Q99714 5/20 0.55
HPGD P15428 7/20 0.55
MAPT P10636 7/20 0.55
KDM4E B2RXH2 5/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
RAB9A P51151 4/20 0.55
GAA P10253 4/20 0.55
NPSR1 Q6W5P4 3/20 0.55
KMT2A Q03164 3/20 0.55
GRM6 O15303 2/20 0.55
NPC1 O15118 2/20 0.55
MEN1 O00255 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
TP53 P04637 1/20 0.53
TSHR P16473 4/20 0.53
LMNA P02545 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52

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
SCHEMBL18803865 0.89 ALDH1A1 (0.59) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL27636759 0.84 ALDH1A1 (0.55) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL4320540 0.83 CA12 (0.72) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL3869093 0.83 TSHR (0.61) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL12998049 0.83 ALDH1A1 (0.59) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL9681966 0.82 ALDH1A1 (0.52) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL5572324 0.82 PTPN1 (0.55) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL26241975 0.81 KDM4E (0.53) ALDH1A1HSD17B10HPGDMAPTKDM4E
SCHEMBL6536225 0.81 ALDH1A1 (0.51) ALDH1A1HPGDMAPTKDM4ESMN1; SMN2
SCHEMBL25194957 0.80 CA12 (0.56) ALDH1A1HSD17B10HPGDMAPTKDM4E

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
US-5149357-A Herbicidal substituted benzoylsulfonamides FMC CORPORATION (US) 1992-09-22 US disclosed
CN-1054590-A The benzoic acid herbicides that 6-aryl-2-replaces FMC CORP (US) 1991-09-18 CN disclosed
WO-1991013065-A1 6-ARYL-2-SUBSTITUTED BENZOIC ACID HERBICIDES FMC CORPORATION (US) 1991-09-05 WO disclosed