SCHEMBL2620564

SCHEMBL2620564

Cc1ccc(OC(C)(C)C(=O)NC2CC3CCC(C2)N3C(=O)c2cccc(C#N)c2)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.42
USP2 O75604 2/20 0.36
SUV39H2 Q9H5I1 1/20 0.36
GRM5 P41594 3/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
HSD11B1 P28845 2/20 0.35
LMNA P02545 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
HSD11B2 P80365 1/20 0.35

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
SCHEMBL2098131 0.93 KDM1A (0.42) KDM1ASUV39H2GRM5HCRTR1HCRTR2
SCHEMBL2098129 0.93 KDM1A (0.42) KDM1ASUV39H2GRM5HCRTR1HCRTR2
SCHEMBL13415855 0.89 KDM1A (0.42) KDM1AUSP2GRM5HSD11B1LMNA
SCHEMBL10287658 0.85 KMT2A (0.44)
SCHEMBL1117123 0.80 KMT2A (0.39) SUV39H2HSD11B1HSD11B2
SCHEMBL1117119 0.80 KMT2A (0.39) SUV39H2HSD11B1HSD11B2
SCHEMBL2620566 0.79 USP2 (0.39) KDM1AUSP2LMNA
SCHEMBL2612630 0.78 KMT2A (0.37) USP2SUV39H2HSD11B1LMNAHSD11B2
SCHEMBL2097985 0.78 KDM4D (0.46) KDM1AGRM5GPR119
SCHEMBL2097983 0.78 KDM4D (0.46) KDM1AGRM5GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163771-B2 11 β-HSD1 modulators EXELIXIS, INC. (US) 2012-04-24 US disclosed
US-20090247515-A1 11 Beta-HSD1 Modulators EXELIXIS, INC. (US) 2009-10-01 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 (1 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-20090247515-A1 11 Beta-HSD1 Modulators HSD11B1, HSD11B2, HSD3B1 KDM1A 780/4885USP2 3074/4885SUV39H2 2698/4885

“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.