SCHEMBL19155129

SCHEMBL19155129

Cc1ccc(F)cc1OCc1ccc(F)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.68
FFAR1 O14842 4/20 0.68
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 1/20 0.51
PKM P14618 1/20 0.51
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
STAT3 P40763 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
MAOB P27338 3/20 0.47
BRD4 O60885 1/20 0.47
HTR1A P08908 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45

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
SCHEMBL15426843 0.89 FFAR4 (0.65) FFAR4FFAR1MEN1KMT2AALDH1A1
SCHEMBL19154981 0.88 FFAR1 (0.56) FFAR4FFAR1MEN1KMT2AALDH1A1
SCHEMBL12301123 0.83 RXRA (0.63) FFAR4FFAR1MEN1KMT2AALDH1A1
SCHEMBL1219328 0.82 FFAR1 (0.51) FFAR4FFAR1MEN1KMT2AALDH1A1
SCHEMBL6832641 0.79 FFAR1 (0.49) FFAR4FFAR1MEN1KMT2AALDH1A1
SCHEMBL13069269 0.79 FFAR1 (0.49) FFAR4FFAR1ALDH1A1LMNAHTT
SCHEMBL22381399 0.76 BRD4 (0.52) FFAR4FFAR1MEN1KMT2AALDH1A1
SCHEMBL22275893 0.76 FFAR1 (0.48) FFAR4FFAR1MEN1KMT2ALMNA
SCHEMBL4749281 0.76 FFAR1 (0.47) FFAR4FFAR1SMN1; SMN2SLC6A2SLC6A4
SCHEMBL13069271 0.76 FFAR1 (0.47) FFAR4FFAR1MEN1KMT2AALDH1A1

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
US-9714230-B2 Histone demethylase inhibitors Celgene Quantical Research, Inc. (US) 2017-07-25 US disclosed