SCHEMBL8301774

SCHEMBL8301774

O=C(O)/C=C/C(=O)Nc1ccc(Cl)cc1C(=O)NCc1ccc2c(c1)OCO2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
TSHR P16473 3/20 0.54
LMNA P02545 5/20 0.52
HTT P42858 4/20 0.52
KDM4E B2RXH2 3/20 0.52
MAPT P10636 3/20 0.52
POLB P06746 2/20 0.52
MAPK1 P28482 2/20 0.52
TP53 P04637 1/20 0.52
ALOX12 P18054 1/20 0.52
HSD17B10 Q99714 1/20 0.52
ALDH1A1 P00352 4/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ALDH2 P05091 1/20 0.51
NPSR1 Q6W5P4 2/20 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
SCHEMBL8301778 1.00 HPGD (0.54) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8301441 0.87 HPGD (0.51) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8301439 0.87 HPGD (0.51) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8293093 0.85 HPGD (0.59) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8300413 0.84 MEN1 (0.58) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8299752 0.83 HPGD (0.55) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8291718 0.83 MEN1 (0.58) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8301382 0.82 MCHR1 (0.63) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8300993 0.82 MEN1 (0.53) HPGDMEN1KMT2ATSHRLMNA
SCHEMBL8300998 0.82 HPGD (0.53) HPGDMEN1KMT2ATSHRLMNA

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
EP-0686625-B1 ANTHRANILIC ACID DERIVATIVE EISAI CO LTD (JP) 1999-05-26 EP disclosed
US-5716993-A PHOSPHODIESTERASE ENZYME INHIBITOR FOR TREATING CARDIOVASCULAR DISORDER, ANGINA PECTORIS, HYPERTENSION, ASTHMA EISAI CO., LTD. (JP) 1998-02-10 US disclosed
EP-0686625-A1 ANTHRANILIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1995-12-13 EP disclosed