SCHEMBL14037320

SCHEMBL14037320

CCC(O)C1(C(=O)O)CCCC1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.34
TSHR P16473 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FFAR3 O14843 1/20 0.32
NFKB1 P19838 1/20 0.31
MME P08473 1/20 0.30

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
SCHEMBL17507162 0.98 CYP2C19 (0.38) CYP2C19TSHRMEN1KMT2AFFAR3
SCHEMBL9935954 0.96 CYP2C19 (0.34) CYP2C19TSHRMEN1KMT2AFFAR3
SCHEMBL20168856 0.91 FFAR3 (0.35) FFAR3
SCHEMBL164042 0.91 FFAR3 (0.35) FFAR3
SCHEMBL4553549 0.91 FFAR3 (0.35) FFAR3
SCHEMBL11387148 0.82 CHRM1 (0.35) CYP2C19TSHRMEN1KMT2ANFKB1
SCHEMBL21085003 0.82
SCHEMBL14795066 0.81 LMNA (0.30)
SCHEMBL15201851 0.80 KCNA3 (0.32)
SCHEMBL13875771 0.79 CA2 (0.37) CYP2C19MEN1KMT2A

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-3180335-A1 CYTOCHROME P450 INHIBITORS AND USES THEREOF Angion Biomedica Corporation (US) 2017-06-21 EP disclosed
WO-2016025424-A1 CYTOCHROME P450 INHIBITORS AND USES THEREOF ANGION BIOMEDICA CORPORATION (US) 2016-02-18 WO disclosed
WO-2008141011-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2008-11-20 WO disclosed