SCHEMBL6489460

SCHEMBL6489460

O=C(O)c1cccc(SCCC2CCCCC2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.54
KMO O15229 1/20 0.49
CYP2C9 P11712 3/20 0.49
HPGD P15428 2/20 0.49
CYP1A2 P05177 2/20 0.49
HSD17B10 Q99714 1/20 0.49
PPM1D O15297 2/20 0.44
KDM4C Q9H3R0 2/20 0.44
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
BMP1 P13497 1/20 0.41
TSHR P16473 1/20 0.41
EPHX1 P07099 1/20 0.41
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL6478831 0.82 KMT2A (0.48) HPGDKDM4CBMP1TSHREPHX1
SCHEMBL26145088 0.81 APEX1 (0.58) APEX1KMOCYP2C9HPGDCYP1A2
SCHEMBL3888986 0.79 APEX1 (0.55) APEX1KMOCYP2C9HPGDCYP1A2
SCHEMBL21609713 0.77 MAOA (0.43) DDB1CRBNALDH1A1SMN1; SMN2MEN1
SCHEMBL22337189 0.77 MAOA (0.43) DDB1CRBNALDH1A1SMN1; SMN2MEN1
SCHEMBL16344775 0.76 APEX1 (0.67) APEX1KMOCYP2C9HPGDCYP1A2
SCHEMBL2193712 0.75 KMT2A (0.58) KMOHPGDSMN1; SMN2KMT2ARAB9A
SCHEMBL6484438 0.75 HPGD (0.56) APEX1KMOCYP2C9HPGDCYP1A2
SCHEMBL6489046 0.74 APEX1 (0.65) APEX1CYP2C9HPGDCYP1A2HSD17B10
SCHEMBL2197741 0.73 PPM1D (0.53) KMOCYP2C9PPM1DKDM4CBMP1

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 APEX1 1768/4885KMO 1997/4885CYP2C9 2947/4885
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP APEX1 1768/4885KMO 1997/4885CYP2C9 2947/4885

“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.