SCHEMBL9318280

SCHEMBL9318280

CCCC(=NC#N)NCC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.39
FFAR3 O14843 3/20 0.37
HDAC3 O15379 3/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC2 Q92769 3/20 0.37
HDAC8 Q9BY41 3/20 0.37
CTH P32929 1/20 0.34
EGLN1 Q9GZT9 2/20 0.34
FAAH O00519 5/20 0.34
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
APEX1 P27695 2/20 0.34
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL9202832 0.83 RECQL (0.42) EGLN1ALDH1A1KDM4ERECQLHSD17B10
SCHEMBL4892460 0.73 CYP2D6 (0.33)
SCHEMBL13989344 0.73 CYP2D6 (0.33)
SCHEMBL4892454 0.73 CYP2D6 (0.33)
SCHEMBL233413 0.68 FAAH (0.55) PLA2G2AFFAR3HDAC3HDAC1HDAC2
SCHEMBL21176794 0.66 FAAH (0.53) PLA2G2AFFAR3HDAC3HDAC1HDAC2
SCHEMBL21176786 0.66 FAAH (0.53) PLA2G2AFFAR3HDAC3HDAC1HDAC2
SCHEMBL21176784 0.66 FAAH (0.53) PLA2G2AFFAR3HDAC3HDAC1HDAC2
SCHEMBL21176788 0.66 FAAH (0.53) PLA2G2AFFAR3HDAC3HDAC1HDAC2
SCHEMBL28618934 0.66 FAAH (0.58) PLA2G2AFFAR3HDAC3HDAC1HDAC2

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
US-5276048-A 4-(1H-pyrrol-1-yl)imidazoles with angiotensin II antagonist activity WARNER-LAMBERT COMPANY (US) 1994-01-04 US disclosed
US-5210211-A 4-(1H-PYRROL-1-YL) IMIDAZOLES WITH ANGIOTENSION II ANTAGONIST ACTIVITY WARNER-LAMBERT COMPANY (US) 1993-05-11 US disclosed