SCHEMBL3870313

SCHEMBL3870313

COC(=O)c1cc(Cl)ccc1NC(=O)[C@H]1CCCC[C@@H]1C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.70
TSHR P16473 1/20 0.70
RECQL P46063 1/20 0.70
HSD17B10 Q99714 1/20 0.70
MAPK1 P28482 1/20 0.69
CYP2C19 P33261 3/20 0.65
HTT P42858 4/20 0.60
POLB P06746 1/20 0.60
RAB9A P51151 1/20 0.60
GRM4 Q14833 2/20 0.58
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ALDH1A1 P00352 1/20 0.53
GLA P06280 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL3870310 1.00 KDM4E (0.70) KDM4ETSHRRECQLHSD17B10MAPK1
SCHEMBL3871074 1.00 KDM4E (0.70) KDM4ETSHRRECQLHSD17B10MAPK1
SCHEMBL1797273 0.79 SERPINE1 (0.51) KDM4ETSHRRECQLHSD17B10MAPK1
SCHEMBL1800176 0.79 SERPINE1 (0.51) KDM4ETSHRRECQLHSD17B10MAPK1
SCHEMBL1797272 0.79 SERPINE1 (0.51) KDM4ETSHRRECQLHSD17B10MAPK1
SCHEMBL539118 0.77 EP300 (0.49) KDM4ETSHRHSD17B10CYP2C19HTT
Hydrochloric Acid SCHEMBL418780 0.76 ROCK2 (0.47) KDM4ETSHRRECQLHSD17B10NPSR1
Hydrochloric Acid SCHEMBL418781 0.76 ROCK2 (0.47) KDM4ETSHRRECQLHSD17B10NPSR1
SCHEMBL495339 0.76 YAP1 (0.65) KDM4ERAB9AKMT2AMEN1ALDH1A1
SCHEMBL539174 0.75 KDM4E (0.51) KDM4ETSHRHSD17B10KMT2ANPSR1

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-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR RENASCIENCE CO., LTD. (JP) 2009-05-14 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-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 KDM4E 4309/4885TSHR 2186/4885RECQL 3673/4885

“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.