SCHEMBL9789536

SCHEMBL9789536

O=C(O)C=C(C(F)F)C(F)F

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.32
TP53 P04637 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 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
SCHEMBL5322632 0.73
SCHEMBL5322635 0.73
SCHEMBL7583787 0.71
SCHEMBL15482702 0.71
SCHEMBL7586719 0.71
Bicarbonate SCHEMBL28231169 0.69 CA1 (0.31)
SCHEMBL4826000 0.69 GABRP (0.36) TSHRTP53EGLN1EGLN3KDM4E
Bicarbonate SCHEMBL20423868 0.67
SCHEMBL27541122 0.63 ALDH1A1 (0.43) TSHRTP53KDM4ELMNA
SCHEMBL104463 0.63

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-5049585-A Certain 3,3-bis-(difluoro methyl)2,2-dimethyl-cyclopropane carboxylates having insecticidal activity IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-09-17 US disclosed