SCHEMBL23189271

SCHEMBL23189271

C[C@H](Cc1ccccc1Br)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 2/20 0.51
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
RECQL P46063 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PPARG P37231 2/20 0.50
PPARA Q07869 1/20 0.50
TSHR P16473 1/20 0.45
HPGD P15428 1/20 0.44
ANPEP P15144 1/20 0.44
PTGER1 P34995 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43
ALDH1A1 P00352 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
RXRA P19793 1/20 0.41
NR4A2 P43354 1/20 0.41

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
SCHEMBL31558898 1.00 APAF1 (0.51) APAF1KDM4EPOLBMAPTRECQL
SCHEMBL1452939 1.00 APAF1 (0.51) APAF1KDM4EPOLBMAPTRECQL
SCHEMBL8520662 0.86 APAF1 (0.59) APAF1KDM4EPOLBMAPTRECQL
SCHEMBL11780395 0.86 APAF1 (0.45) APAF1KDM4EPOLBMAPTRECQL
SCHEMBL24709576 0.85 ANPEP (0.44) APAF1KDM4EPOLBMAPTRECQL
SCHEMBL1454104 0.84 PPARG (0.46) APAF1KDM4EPOLBMAPTRECQL
SCHEMBL2387476 0.82 KMT2A (0.58) KDM4EPPARGPPARAHPGDALDH1A1
SCHEMBL16995424 0.82 TSHR (0.50) APAF1KDM4EPOLBMAPTRECQL
SCHEMBL14483930 0.82 ANPEP (0.43) PPARGPPARATSHRHPGDANPEP
SCHEMBL7386121 0.81 CYP1A2 (0.55) PPARGPPARATSHRALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464324-B1 ANGIOTENSIN-1-RECEPTOR ANTAGONISTS FERRING BV (NL) 2021-04-07 EP disclosed