SCHEMBL6477206

SCHEMBL6477206

NN(CC1CC1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 4/20 0.42
OPRK1 P41145 4/20 0.42
OPRD1 P41143 3/20 0.42
PTGIR P43119 2/20 0.37
HTT P42858 1/20 0.36
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
PTGDR Q13258 1/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ESR1 P03372 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
GBA1 P04062 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL6489498 0.92 OPRM1 (0.44) OPRM1OPRK1OPRD1DRD2DRD3
SCHEMBL6476702 0.90 OPRM1 (0.43) OPRM1OPRK1OPRD1HDAC1HDAC6
SCHEMBL6475795 0.90 OPRM1 (0.43) OPRM1OPRK1OPRD1HDAC1HDAC6
SCHEMBL18421862 0.77 SLC6A2 (0.45) OPRM1OPRK1OPRD1PTGIRHTT
SCHEMBL5180956 0.75 LMNA (0.51) KDM4EALDH1A1TDP1L3MBTL1
SCHEMBL12225935 0.74 PTGIR (0.43) OPRM1OPRK1OPRD1PTGIRHTT
SCHEMBL30171515 0.74 SLC6A2 (0.40) OPRM1OPRK1OPRD1PTGIRDRD2
SCHEMBL5842151 0.72 ALDH1A1 (0.50) OPRM1OPRK1OPRD1KDM4EALDH1A1
SCHEMBL3819538 0.72 OPRM1 (0.35) OPRM1OPRK1OPRD1SLC6A2SLC6A4
SCHEMBL3426762 0.71 KCNA5 (0.41) DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887863-B2 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES (US) 2005-05-03 US disclosed
EP-1272456-B1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2004-10-27 EP disclosed
US-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBVIE INC. 2004-08-26 US disclosed
EP-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP disclosed
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES 2002-01-03 US disclosed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP OPRM1 2982/4885OPRK1 4415/4885OPRD1 4047/4885
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP OPRM1 2982/4885OPRK1 4415/4885OPRD1 4047/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.