SCHEMBL9751693

SCHEMBL9751693

CC(=O)Oc1ccc(OC2(Oc3ccc(OC(C)=O)cc3)C(F)(F)C(F)(F)C2(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.52
MAPT P10636 5/20 0.47
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
ELANE P08246 2/20 0.46
HSD17B10 Q99714 2/20 0.44
GAA P10253 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HSP90AA1 P07900 1/20 0.43
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TP53 P04637 2/20 0.42
CYP3A4 P08684 2/20 0.42
TTR P02766 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GLA P06280 1/20 0.41
ESR1 P03372 1/20 0.40
PGR P06401 1/20 0.40
CHRM2 P08172 1/20 0.40

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
SCHEMBL9172657 0.83 LMNA (0.53) LMNAMAPTPOLBPKMELANE
SCHEMBL269329 0.77 LMNA (0.80) LMNAMAPTPOLBPKMELANE
Lithium SCHEMBL30522746 0.75 LMNA (0.76) LMNAMAPTPOLBPKMELANE
SCHEMBL14760365 0.75 LMNA (0.76) LMNAMAPTPOLBPKMELANE
SCHEMBL9764749 0.74 ALDH1A1 (0.36) MAPTALDH1A1KMT2AHPGDRAB9A
Phosphine SCHEMBL27576228 0.71 LMNA (0.95) LMNAMAPTPOLBPKMELANE
SCHEMBL660921 0.71 LMNA (0.64) LMNAMAPTPOLBPKMELANE
SCHEMBL24435576 0.71 LMNA (0.70) LMNAMAPTPOLBPKMELANE
SCHEMBL9760958 0.71 LMNA (0.70) LMNAMAPTPOLBPKMELANE
SCHEMBL9325116 0.71 LMNA (0.70) LMNAMAPTPOLBPKMELANE

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
EP-0428709-A1 REACTIVE COMPOUNDS CONTAINING PERFLUOROVINYL GROUPS. DOW CHEMICAL CO (US) 1991-05-29 EP disclosed
WO-1990015042-A2 REACTIVE COMPOUNDS CONTAINING PERFLUOROVINYL GROUPS THE DOW CHEMICAL COMPANY (US) 1990-12-13 WO disclosed