SCHEMBL9575158

SCHEMBL9575158

C=C(F)C(=O)Oc1cc(C)c(C(C)C)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.33
LDHA P00338 1/20 0.32
LDHB P07195 1/20 0.32
PLA2G1B P04054 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 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
SCHEMBL9575440 0.79 FABP3 (0.35)
SCHEMBL9575199 0.77 MEN1 (0.41) TDP1THRB
SCHEMBL9575371 0.73 CHEK2 (0.37) TDP1
SCHEMBL9576707 0.72 SMN1; SMN2 (0.47) THRB
SCHEMBL9575148 0.71 CYP4F2 (0.41)
SCHEMBL9575341 0.70 MRGPRX4 (0.42) TDP1
SCHEMBL9575396 0.69 LMNA (0.55)
SCHEMBL9575635 0.69 TPMT (0.35)
SCHEMBL16641111 0.69
SCHEMBL9655860 0.68 CYP3A4 (0.33)

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
US-5266668-A Substituted phenyl α-fluoroacrylates HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-30 US disclosed
EP-0249867-B1 SUBSTITUTED PHENYL ESTERS OF ALPHA-FLUOROACRYLIC ACID HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-02 EP disclosed