SCHEMBL7695022

SCHEMBL7695022

CC=C(Oc1cccc(C)c1)C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
ACHE P22303 1/20 0.52
MAPK1 P28482 2/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP3A4 P08684 2/20 0.49
GAA P10253 2/20 0.49
FAAH O00519 1/20 0.49
MAPT P10636 3/20 0.48
POLB P06746 1/20 0.47
BCHE P06276 1/20 0.46
KMT2A Q03164 3/20 0.45
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALOX5 P09917 1/20 0.43
KCNK3 O14649 1/20 0.43
KCNK9 Q9NPC2 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL7695017 0.88 LMNA (0.54) LMNAACHEMAPK1ALDH1A1CYP3A4
SCHEMBL7695019 0.88 LMNA (0.54) LMNAACHEMAPK1ALDH1A1CYP3A4
SCHEMBL8486182 0.83 CES2 (0.41) ALDH1A1KMT2ASMN1; SMN2MEN1NPC1
SCHEMBL8026284 0.81 NPC1 (0.54) LMNAMAPK1ALDH1A1KMT2AKCNK3
SCHEMBL7688667 0.79 MTNR1A (0.44) LMNAACHEALDH1A1KMT2ASMN1; SMN2
SCHEMBL7922562 0.79 LMNA (0.74) LMNAACHEMAPK1ALDH1A1CYP3A4
SCHEMBL410350 0.78 LMNA (0.67) LMNAACHEMAPK1ALDH1A1CYP3A4
SCHEMBL28592787 0.77 LMNA (0.66) LMNAACHEMAPK1ALDH1A1CYP3A4
SCHEMBL6129241 0.75 LMNA (0.69) LMNAACHEMAPK1ALDH1A1CYP3A4
SCHEMBL6129242 0.75 LMNA (0.69) LMNAACHEMAPK1ALDH1A1CYP3A4

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
US-6337306-B1 HERBICIDES FOR AGRICULTURE RHONE-POULENC AGRO (FR) 2002-01-08 US disclosed
EP-0961766-A1 PHENOXYACETIC ACID DERIVATIVES AND THEIR USE AS HERBICIDES Rhone Poulenc Agro (FR) 1999-12-08 EP disclosed
WO-1998034898-A1 PHENOXYACETIC ACID DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRO (FR) 1998-08-13 WO disclosed