SCHEMBL6570054

SCHEMBL6570054

CCCCCON=CCc1c[c]ccc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
TSHR P16473 2/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
LMNA P02545 1/20 0.31
GGPS1 O95749 1/20 0.31
HPGD P15428 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
SCHEMBL6568844 0.99 ALDH1A1 (0.38) ALDH1A1PPARGPPARATSHRTP53
SCHEMBL7628651 0.96 PPARG (0.36) ALDH1A1PPARGPPARATSHRCYP3A4
SCHEMBL6569509 0.90 PPARG (0.33) PPARGPPARA
SCHEMBL6570415 0.84
SCHEMBL6570510 0.82 ALDH1A1 (0.36) ALDH1A1PPARGPPARA
SCHEMBL7965211 0.82 ALDH1A1 (0.50) ALDH1A1PPARGPPARATSHRTP53
SCHEMBL6570036 0.81 ALDH1A1 (0.38) ALDH1A1PPARGPPARATSHRTP53
SCHEMBL7968373 0.81 ALDH1A1 (0.52) ALDH1A1PPARGPPARATSHRTP53
SCHEMBL7629516 0.78 ESR1 (0.34) ALDH1A1PPARGPPARA
SCHEMBL6568693 0.77 ALDH1A1 (0.33) ALDH1A1MAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0463488-B2 O-Benzyl oxime ethers and fungicides containing them BASF AG (DE) 2004-04-21 EP claimed
EP-0463488-B2 O-Benzyl oxime ethers and fungicides containing them BASF AG (DE) 2004-04-21 EP disclosed
US-RE37839-E1 O-benzyloxime ethers and crop protection agents containing these compounds BASF AKTIENGESELLSCHAFT (DE) 2002-09-10 US disclosed
US-6326399-B1 CONTROLLING INSECTS, ARACHNIDS, NEMATODES BASF AKTIENGESELLSCHAFT (DE) 2001-12-04 US disclosed
US-6316459-B1 O-benzyloxime ethers and crop protection agents containing these compounds BASF AG (DE) 2001-11-13 US disclosed
US-6211190-B1 Pyrimidine derivatives, process and intermediate products for their preparation and pesticides or fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US disclosed
CN-1161687-A Phenylacetic acid alkyl esters BASF AG (DE) 1997-10-08 CN disclosed