SCHEMBL21770540

SCHEMBL21770540

COC(=O)c1cc2ccccccccc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.67
LMNA P02545 2/20 0.67
TP53 P04637 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
XDH P47989 1/20 0.67
MAPT P10636 1/20 0.66
DAO P14920 1/20 0.66
HPGD P15428 1/20 0.66
SRD5A2 P31213 1/20 0.66
HSD17B10 Q99714 1/20 0.66
FLT3 P36888 4/20 0.62
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
ALDH1A1 P00352 1/20 0.58
GAA P10253 1/20 0.58
MAPK1 P28482 1/20 0.58
PDGFRB P09619 3/20 0.57
PDGFRA P16234 3/20 0.57
PTPN2 P17706 1/20 0.57

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
SCHEMBL519591 0.98 KDM4E (0.69) KDM4ELMNATP53L3MBTL1XDH
SCHEMBL29493369 0.98 KDM4E (0.69) KDM4ELMNATP53L3MBTL1XDH
Hydrochloric Acid SCHEMBL4591208 0.97 KDM4E (0.67) KDM4ELMNATP53L3MBTL1XDH
Hydrochloric Acid SCHEMBL5159238 0.97 KDM4E (0.67) KDM4ELMNATP53L3MBTL1XDH
Tetrahydrofuran SCHEMBL27478637 0.87 KDM4E (0.56) KDM4ELMNATP53L3MBTL1XDH
SCHEMBL29256722 0.83 XDH (0.56) KDM4ELMNATP53L3MBTL1XDH
SCHEMBL28304567 0.81 KDM4E (0.64) KDM4ELMNATP53L3MBTL1XDH
SCHEMBL5957825 0.81 FLT3 (0.61) KDM4ELMNATP53L3MBTL1MAPT
SCHEMBL5188980 0.81 FLT3 (0.65) KDM4ELMNATP53L3MBTL1MAPT
SCHEMBL3851187 0.81 FLT3 (0.65) KDM4ELMNATP53L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200063110-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF PROMEGA CORPORATION 2020-02-27 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-20200063110-A1 THIENOPYRROLE COMPOUNDS AND USES THEREOF THOP1, TYMP, CREBBP KDM4E 1930/4885LMNA 4219/4885TP53 3720/4885

“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.