SCHEMBL6476599

SCHEMBL6476599

O=C(O)c1ccc(SC2CCCCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.58
MAOA P21397 4/20 0.51
MAOB P27338 4/20 0.51
SRD5A2 P31213 2/20 0.50
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
GRIK1 P39086 1/20 0.49
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
HSD11B1 P28845 1/20 0.41
KMO O15229 1/20 0.41
EPHX2 P34913 2/20 0.40
EPHX1 P07099 1/20 0.40
PTGIR P43119 1/20 0.40
NPSR1 Q6W5P4 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
SCHEMBL507051 1.00 KMT2A (0.58) KMT2AMAOAMAOBSRD5A2DDB1
SCHEMBL28230023 0.94 KMT2A (0.51) KMT2AMAOAMAOBSRD5A2DDB1
SCHEMBL15218707 0.91 KMT2A (0.50) KMT2AMAOAMAOBSRD5A2DDB1
SCHEMBL4415667 0.90 GRIK1 (0.56) KMT2AMAOAMAOBSRD5A2DDB1
SCHEMBL507534 0.84 MAOA (0.50) KMT2AMAOAMAOBTSHRPTGIR
SCHEMBL10229754 0.84 HPGD (0.52) KMT2AMAOAMAOBTSHREPHX1
SCHEMBL23639274 0.83 KMT2A (0.47) KMT2AMAOAMAOBSRD5A2DDB1
SCHEMBL21579073 0.83 KMT2A (0.47) KMT2AMAOAMAOBSRD5A2DDB1
SCHEMBL21579076 0.83 GRIK1 (0.46) KMT2AMAOAMAOBSRD5A2DDB1
SCHEMBL2744381 0.82 USP2 (0.50) KMT2ASRD5A2DDB1CRBNGRIK1

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 KMT2A 648/4885MAOA 564/4885MAOB 253/4885
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP KMT2A 648/4885MAOA 564/4885MAOB 253/4885

“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.