SCHEMBL15224006

SCHEMBL15224006

COc1ccc2[nH]c(CC(C)=O)cc2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.65
MTNR1B P49286 2/20 0.65
LOXL2 Q9Y4K0 1/20 0.63
PDGFRB P09619 2/20 0.59
PDGFRA P16234 2/20 0.59
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 3/20 0.55
NPC1 O15118 1/20 0.55
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
RAB9A P51151 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
POLB P06746 1/20 0.54
GAA P10253 1/20 0.54
AXL P30530 1/20 0.53
FLT3 P36888 5/20 0.52
HRH3 Q9Y5N1 1/20 0.52
MEN1 O00255 1/20 0.51
CYP1A2 P05177 1/20 0.51

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
SCHEMBL29390774 0.88 LOXL2 (0.63) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL1331625 0.88 LOXL2 (0.63) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL9679411 0.87 MTNR1A (0.64) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL8578346 0.87 LOXL2 (0.61) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL12392706 0.84 LOXL2 (0.58) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL13091580 0.84 MTNR1A (0.61) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL11623541 0.82 MTNR1A (0.62) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL11622077 0.81 LOXL2 (0.71) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL8946252 0.81 MTNR1A (0.67) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA
SCHEMBL867547 0.80 LOXL2 (0.75) MTNR1AMTNR1BLOXL2PDGFRBPDGFRA

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-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-11-23 US disclosed
US-9815784-B2 CC-1065 analogs and their conjugates SYNTARGA B.V. (NL) 2017-11-14 US disclosed
US-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-09-28 US disclosed
US-9629924-B2 Conjugates of CC-1065 analogs and bifunctional linkers SYNTARGA BV (NL) 2017-04-25 US disclosed
US-20130224227-A1 NOVEL CONJUGATES OF CC-1065 ANALOGS AND BIFUNCTIONAL LINKERS BYONDIS B.V. (NL) 2013-08-29 US disclosed
US-20110207767-A1 Novel cc-1065 Analogs and Their Conjugates BYONDIS B.V. (NL) 2011-08-25 US 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 (4 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-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L MTNR1A 3704/4885MTNR1B 3821/4885LOXL2 4108/4885
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L MTNR1A 3704/4885MTNR1B 3821/4885LOXL2 4108/4885
US-20110207767-A1 Novel cc-1065 Analogs and Their Conjugates PCNA, CDC5L, TOP1 MTNR1A 3531/4885MTNR1B 3609/4885LOXL2 4585/4885
US-20130224227-A1 NOVEL CONJUGATES OF CC-1065 ANALOGS AND BIFUNCTIONAL LINKERS PCNA, DCLRE1A, CDC5L MTNR1A 3704/4885MTNR1B 3821/4885LOXL2 4108/4885

“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.