SCHEMBL7070883

SCHEMBL7070883

O=C(O)C=C(F)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
SRD5A2 P31213 1/20 0.50
PDPK1 O15530 1/20 0.44
KMO O15229 5/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL7070720 0.79 ALOX15 (0.52) TSHRSRD5A2PDPK1MEN1KMT2A
SCHEMBL6704901 0.78 TSHR (0.57) TSHRSRD5A2PDPK1KMOMEN1
SCHEMBL4024078 0.78 TSHR (0.57) TSHRSRD5A2PDPK1KMOMEN1
Hydrochloric Acid SCHEMBL6785536 0.76 TSHR (0.55) TSHRSRD5A2PDPK1KMOMEN1
SCHEMBL7071171 0.76 MAPT (0.46) TSHRMAPTHPGDSMN1; SMN2
SCHEMBL625586 0.76 MAPT (0.55) TSHRMEN1KMT2AKDM4EMAPT
SCHEMBL7072539 0.76 TTR (0.36) PDPK1MAPTHPGD
SCHEMBL17802354 0.75 TSHR (0.53) TSHRSRD5A2PDPK1KMONPC1
SCHEMBL17802357 0.75 TSHR (0.53) TSHRSRD5A2PDPK1KMONPC1
SCHEMBL726541 0.75 TSHR (0.53) TSHRSRD5A2PDPK1KMOMEN1

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
EP-0946492-B1 NOVEL 2-FLUOROACRYLIC ACID DERIVATIVES, NOVEL MIXTURES OF HERBICIDES AND ANTIDOTES AND THE USE THEREOF BAYER CROPSCIENCE GMBH (DE) 2003-06-18 EP claimed