SCHEMBL9312974

SCHEMBL9312974

C=C(F)CCOc1ccccc1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.57
MAPK1 P28482 1/20 0.57
RAB9A P51151 1/20 0.57
LMNA P02545 2/20 0.56
HTR7 P34969 1/20 0.54
ADRB2 P07550 5/20 0.51
KDM4E B2RXH2 4/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 2/20 0.51
ADRB1 P08588 2/20 0.51
HTT P42858 3/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
USP2 O75604 1/20 0.48

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
SCHEMBL156467 0.82 KDM4E (0.58) TP53MAPK1RAB9ALMNAKDM4E
SCHEMBL9870817 0.82 TP53 (0.70) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL29418129 0.81 TP53 (0.69) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL159005 0.81 TP53 (0.69) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL13739595 0.81 TP53 (0.74) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL4907668 0.79 KDM4E (0.59) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL15522001 0.79 TP53 (0.71) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL13740267 0.79 TP53 (0.71) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL9857798 0.78 TP53 (0.65) TP53MAPK1RAB9ALMNAHTR7
SCHEMBL4625628 0.78 TP53 (0.65) TP53MAPK1RAB9ALMNAHTR7

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-5298188-A Chiral compound containing pyran and diphenyl rings and fluorine THOMSON-CSF (FR) 1994-03-29 US disclosed