SCHEMBL5261384

SCHEMBL5261384

O=c1oc(-c2cccc3ccccc23)nc2ccc(F)cc12

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
C1R P00736 11/20 0.58
HPN P05981 1/20 0.52
KMT2A Q03164 3/20 0.51
F2 P00734 2/20 0.51
PLG P00747 1/20 0.51
KLK1 P06870 1/20 0.51
PRSS1 P07477 1/20 0.51
C1S P09871 1/20 0.51
ATM Q13315 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ESR1 P03372 1/20 0.51
ESR2 Q92731 1/20 0.51
MAPT P10636 3/20 0.50
GAA P10253 1/20 0.50
APEX1 P27695 1/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL2816912 0.84 C1R (0.69) C1RKMT2AF2PLGKLK1
SCHEMBL4194659 0.84 C1R (0.72) C1RKMT2AF2PLGKLK1
SCHEMBL5257308 0.84 C1R (0.72) C1RKMT2AF2PLGKLK1
SCHEMBL9475739 0.79 C1R (0.76) C1RKMT2AF2PLGKLK1
SCHEMBL5921548 0.79 C1R (0.55) C1RKMT2APRSS1MAPTGAA
SCHEMBL17870594 0.78 C1R (0.74) C1RKMT2AF2PLGKLK1
SCHEMBL5437118 0.77 F7 (0.56) C1RKMT2AF2PLGKLK1
SCHEMBL4202365 0.76 MEN1 (0.75) C1RKMT2APRSS1MAPTMEN1
SCHEMBL4194349 0.76 APEX1 (0.72) C1RKMT2AF2PLGKLK1
SCHEMBL17554083 0.75 APEX1 (0.76) C1RKMT2AF2PLGKLK1

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
EP-1756044-A1 THERAPEUTIC COMPOUNDS AstraZeneca AB (SE) 2007-02-28 EP disclosed
WO-2005115972-A1 THERAPEUTIC COMPOUNDS ASTRAZENECA AB (SE) 2005-12-08 WO disclosed