SCHEMBL4701959

SCHEMBL4701959

FC(F)(CBr)c1ccc(Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
LMNA P02545 1/20 0.38
CYP2A6 P11509 1/20 0.38
MIF P14174 1/20 0.38
CNR1 P21554 1/20 0.37
GSK3B P49841 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
P2RX3 P56373 1/20 0.33
KIF11 P52732 1/20 0.33
KCNH2 Q12809 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33

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
SCHEMBL4785402 0.78 KCNN4 (0.37) CYP19A1GSK3B
SCHEMBL19510596 0.78 CA1 (0.43) MAPK1CYP2A6GSK3B
SCHEMBL8585123 0.76 MEN1 (0.44) CYP19A1MEN1KMT2ATSHRMAPK1
SCHEMBL29058881 0.76 TSHR (0.43) CYP19A1MEN1KMT2ATSHRMAPK1
SCHEMBL8327958 0.76 CYP19A1 (0.46) CYP19A1MEN1KMT2ATSHRMAPK1
SCHEMBL28677231 0.75 MEN1 (0.42) CYP19A1MEN1KMT2ATSHRMAPK1
SCHEMBL2281974 0.75 TSHR (0.50) MEN1KMT2ATSHRMAPK1CNR1
Hydrochloric Acid SCHEMBL29098622 0.74 TSHR (0.42) CYP19A1MEN1KMT2ATSHRMAPK1
SCHEMBL12869567 0.74 LMNA (0.47) CYP19A1MEN1KMT2ATSHRMAPK1
SCHEMBL18550460 0.71 SLC6A2 (0.41) CYP19A1MEN1KMT2ALMNACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1567489-B1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LTD (GB) 2008-07-23 EP disclosed
US-20060166985-A1 Pyrrolydin-2-one derivatives as inhibitors of thrombin and factor xa GLAXO GROUP LIMITED (GB) 2006-07-27 US disclosed
EP-1567489-A1 PYRROLIDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LIMITED (GB) 2005-08-31 EP disclosed
WO-2004052851-A1 PYRROLYDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LIMITED (GB) 2004-06-24 WO disclosed
WO-2004052851-A1 PYRROLYDIN-2-ONE DERIVATIVES AS INHIBITORS OF THROMBIN AND FACTOR XA GLAXO GROUP LIMITED (GB) 2004-06-24 WO 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-20060166985-A1 Pyrrolydin-2-one derivatives as inhibitors of thrombin and factor xa TFPI, TFPI2, SERPINC1 CYP19A1 999/4885MEN1 1732/4885KMT2A 3662/4885

“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.