SCHEMBL20103672

SCHEMBL20103672

COC(=O)C(C)(F)C(c1cccc(OC)c1)C1CC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.57
POLB P06746 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 1/20 0.44
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PDK1 Q15118 1/20 0.41
PDK2 Q15119 1/20 0.41
PDK3 Q15120 1/20 0.41
PDK4 Q16654 1/20 0.41
ROCK2 O75116 1/20 0.41
PRKG1 Q13976 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
SCHEMBL20103584 0.89 FFAR1 (0.66) FFAR1POLBL3MBTL1MEN1KMT2A
SCHEMBL21644844 0.87 FFAR1 (0.49) FFAR1POLBMEN1KMT2AALDH1A1
SCHEMBL21644842 0.87 FFAR1 (0.49) FFAR1POLBMEN1KMT2AALDH1A1
SCHEMBL21644846 0.87 FFAR1 (0.49) FFAR1POLBMEN1KMT2AALDH1A1
SCHEMBL21688368 0.86 FFAR1 (0.46) FFAR1POLBMEN1KMT2AALDH1A1
SCHEMBL20103443 0.86 FFAR1 (0.44) FFAR1POLB
SCHEMBL20103446 0.86 FFAR1 (0.44) FFAR1POLB
SCHEMBL20103527 0.86 FFAR1 (0.44) FFAR1POLB
SCHEMBL21688395 0.85 FFAR1 (0.43) FFAR1L3MBTL1ALDH1A1
SCHEMBL21688298 0.84 FFAR1 (0.43) FFAR1KMT2AMAPK1

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
WO-2018081047-A1 CYCLOHEXYL GPR40 AGONISTS FOR THE TREATMENT OF TYPE II DIABETES JANSSEN PHARMACEUTICA NV (BE) 2018-05-03 WO disclosed