SCHEMBL8303811

SCHEMBL8303811

CCOP(=O)(CC(=O)OOc1ccccc1)OCC

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.46
MAPT P10636 1/20 0.46
POLB P06746 2/20 0.44
KCNH2 Q12809 1/20 0.42
NPSR1 Q6W5P4 2/20 0.40
NR1I2 O75469 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ACHE P22303 1/20 0.37

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
SCHEMBL10894517 0.84 ELANE (0.45) MAPK1MAPTPOLBKCNH2NPSR1
SCHEMBL11578594 0.77 LMNA (0.45) MAPK1MAPTPOLBNR1I2MEN1
SCHEMBL2044409 0.77 ELANE (0.42) MAPK1MAPTPOLBNPSR1NR1I2
SCHEMBL905941 0.76 ELANE (0.49) MAPTKMT2AHPGDALOX15ACHE
SCHEMBL5849992 0.75 ALDH1A1 (0.53) MAPK1MAPTPOLBKMT2ATSHR
SCHEMBL16601102 0.75 ALOX15 (0.49) MAPK1MAPTPOLBMEN1KMT2A
SCHEMBL8467275 0.74 ELANE (0.47) MAPK1MAPTPOLBMEN1KMT2A
SCHEMBL6915874 0.74 MAPK1 (0.48) MAPK1MAPTPOLBNPSR1NR1I2
SCHEMBL1305579 0.73 POLB (0.59) MAPK1MAPTPOLBKCNH2NPSR1
SCHEMBL577685 0.73 CES2 (0.44) MAPTPOLBMEN1KMT2AHPGD

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-0912511-A1 5-INDOLYL-2,4-PENTADIENOIC ACID DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION Smithkline Beecham S.p.A. (IT) 1999-05-06 EP disclosed
WO-1998001423-A1 5-INDOLYL-2,4-PENTADIENOIC ACID DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION SMITHKLINE BEECHAM S.P.A. (IT) 1998-01-15 WO disclosed