SCHEMBL7379441

SCHEMBL7379441

Oc1cc(O)nc(-c2ccc(OCc3ccccc3)cc2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
PTGS1 P23219 1/20 0.59
SLC6A2 P23975 1/20 0.59
CYP2C19 P33261 1/20 0.59
PTGS2 P35354 1/20 0.59
SLC6A3 Q01959 1/20 0.59
HIF1A Q16665 1/20 0.59
HDAC6 Q9UBN7 1/20 0.59
GSTP1 P09211 1/20 0.54
NR4A1 P22736 1/20 0.53
NR4A2 P43354 1/20 0.53
NR4A3 Q92570 1/20 0.53
MCL1 Q07820 3/20 0.52
MAOB P27338 3/20 0.52
XDH P47989 1/20 0.52
ALOX5 P09917 1/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51

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
SCHEMBL7379345 0.81 PRMT5 (0.59) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL6534828 0.81 LMNA (0.62) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL7373421 0.81 MCL1 (0.59) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL9424180 0.80 LMNA (0.53) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL9566532 0.79 DHFR (0.73) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL29407517 0.79 MAPT (0.60) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL1467485 0.79 MAPT (0.60) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL4302609 0.78 MAOB (0.53) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL254671 0.78 LMNA (0.88) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8367548 0.77 EGFR (0.51) LMNACYP1A2PTGS1SLC6A2CYP2C19

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
US-6372751-B1 DRUGS WITH BENZENE AND PYRIMIDINE RINGS BERLEX LABORATORIES, INC. 2002-04-16 US disclosed
EP-1135131-A4 ARYL AND HETEROCYCLYL SUBSTITUTED PYRIMIDINE DERIVATIVES AS ANTI-COAGULANTS BERLEX LAB (US) 2002-01-02 EP disclosed
EP-1135131-A1 ARYL AND HETEROCYCLYL SUBSTITUTED PYRIMIDINE DERIVATIVES AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 2001-09-26 EP disclosed
US-6127376-A A BLOOD FACTOR XA ENZYME INHIBITOR TREATING A HUMAN HAVING A DISEASE-STATE CHARACTERIZED BY THROMBOTIC ACTIVITY BERLEX LABORATORIES, INC. (US) 2000-10-03 US disclosed
WO-2000033844-A1 ARYL AND HETEROCYCLYL SUBSTITUTED PYRIMIDINE DERIVATIVES AS ANTI-COAGULANTS BERLEX LATORATORIES, INC. (US) 2000-06-15 WO disclosed