SCHEMBL1014577

SCHEMBL1014577

COC(=O)c1cc(-c2ccc(F)cc2)ccc1NC(=O)COCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
CRHBP P24387 1/20 0.48
CRHR2 Q13324 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TSHR P16473 3/20 0.47
ALDH1A1 P00352 6/20 0.44
MAPT P10636 4/20 0.44
HSD17B10 Q99714 3/20 0.44
MAPK10 P53779 1/20 0.43
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
HCAR2 Q8TDS4 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL1799563 0.90 KDM4E (0.52) KDM4ECRHBPCRHR2NPSR1TSHR
SCHEMBL1800306 0.90 TSHR (0.51) KDM4ECRHBPCRHR2NPSR1TSHR
SCHEMBL1016922 0.88 ALDH1A1 (0.43) KDM4ENPSR1TSHRALDH1A1MAPT
SCHEMBL1800596 0.86 ALDH1A1 (0.54) KDM4ETSHRALDH1A1MAPTHSD17B10
SCHEMBL1796132 0.85 TSHR (0.47) KDM4ETSHRALDH1A1MAPTHSD17B10
SCHEMBL1800597 0.83 PTPN1 (0.56) KDM4ETSHRALDH1A1MAPTHSD17B10
SCHEMBL1015454 0.82 ALDH1A1 (0.51) KDM4EALDH1A1MAPTCYP1A2CYP2C19
SCHEMBL1015634 0.82 ALDH1A1 (0.53) KDM4EALDH1A1MAPTTP53KMT2A
SCHEMBL1015370 0.80 KDM4E (0.60) KDM4ETSHRALDH1A1MAPTHSD17B10
SCHEMBL1796641 0.80 ALDH1A1 (0.57) KDM4ECRHBPCRHR2NPSR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8415479-B2 Inhibitor of plasminogen activator inhibitor-1 RENASCIENCE CO., LTD. (JP) 2013-04-09 US disclosed
US-20110112140-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 RENASCIENCE CO., LTD. (JP) 2011-05-12 US disclosed
EP-2272822-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 Renascience CO., LTD. (JP) 2011-01-12 EP 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-20110112140-A1 INHIBITOR OF PLASMINOGEN ACTIVATOR INHIBITOR-1 SERPINE1, SERPINB1, SERPINC1 KDM4E 4108/4885CRHBP 1837/4885CRHR2 4123/4885

“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.