SCHEMBL15872111

SCHEMBL15872111

COc1ccc([C@H]2C(=O)NC(=O)[C@H]2c2cn3c4c(cccc24)CCC3)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPA1 O60313 1/20 0.63
EIF5B O60841 1/20 0.63
MET P08581 1/20 0.63
HMOX2 P30519 1/20 0.63
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MTNR1A P48039 7/20 0.37
MTNR1B P49286 7/20 0.37
USP2 O75604 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
DDB1 Q16531 1/20 0.36

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
SCHEMBL1395775 1.00 OPA1 (0.63) OPA1EIF5BMETHMOX2KDM4E
SCHEMBL5299701 0.90 OPA1 (0.61) OPA1EIF5BMETHMOX2MAPT
SCHEMBL1395846 0.90 OPA1 (0.61) OPA1EIF5BMETHMOX2MAPT
SCHEMBL1395847 0.88 OPA1 (0.61) OPA1EIF5BMETHMOX2HTR2A
SCHEMBL1395820 0.87 OPA1 (0.60) OPA1EIF5BMETHMOX2KDM4E
SCHEMBL1395828 0.87 OPA1 (0.73) OPA1EIF5BMETHMOX2KDM4E
SCHEMBL5307336 0.86 OPA1 (0.66) OPA1EIF5BMETHMOX2KDM4E
SCHEMBL1395726 0.86 OPA1 (0.66) OPA1EIF5BMETHMOX2HTR2A
SCHEMBL1395821 0.86 OPA1 (0.66) OPA1EIF5BMETHMOX2KDM4E
SCHEMBL1395827 0.86 OPA1 (0.66) OPA1EIF5BMETHMOX2KDM4E

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-9447088-B2 Compositions and methods for treatment of cancer ARQULE, INC. (US) 2016-09-20 US disclosed
US-20140200199-A1 Compositions and Methods for Treatment of Cancer ARQULE, INC. 2014-07-17 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-20140200199-A1 Compositions and Methods for Treatment of Cancer MKI67, NUP205, TP53 OPA1 88/4885EIF5B 402/4885MET 2895/4885

“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.