SCHEMBL7093403

SCHEMBL7093403

CCOC(=O)/C(C)=C/C1C(C(=O)O)C1(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
GLO1 Q04760 1/20 0.37
TDP1 Q9NUW8 3/20 0.33
CYP2D6 P10635 3/20 0.33
ALDH1A1 P00352 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 1/20 0.32
TSHR P16473 2/20 0.32
EGLN1 Q9GZT9 1/20 0.32
CYP2C19 P33261 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
ADRA2A P08913 1/20 0.31

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
SCHEMBL10594597 1.00 LMNA (0.55) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL10594600 1.00 LMNA (0.55) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL7093404 1.00 LMNA (0.55) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL10594599 1.00 LMNA (0.55) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL10594613 1.00 LMNA (0.55) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL7093406 1.00 LMNA (0.55) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL10594606 1.00 LMNA (0.55) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL10561807 0.86 LMNA (0.50) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL10561797 0.86 LMNA (0.50) LMNAGLO1TDP1CYP2D6ALDH1A1
SCHEMBL10563981 0.86 LMNA (0.50) LMNAGLO1TDP1CYP2D6ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1018503-B1 Process of producing cyclopropanecarboxylate compounds SUMITOMO CHEMICAL CO (JP) 2003-08-13 EP disclosed
US-6414181-B1 REACTING CYCLOPROPANECARBALDEHYDE COMPOUND WITH DICARBOXYLATE COMPOUND IN PRESENCE OF AT LEAST ONE SECONDARY AMINE CHOOSEN FROM PIPERIDINE, MORPHOLINE, PYRROLIDINE, DIETHYLAMINE AND N-METHYLETHANOLAMINE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-07-02 US disclosed
EP-1018503-A1 Process of producing cyclopropanecarboxylate compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-07-12 EP disclosed