SCHEMBL8205301

SCHEMBL8205301

CO/N=C(/C(N)=O)c1ccc(COc2ccccc2C)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.61
RXRB P28702 2/20 0.61
RXRG P48443 2/20 0.61
MAPT P10636 3/20 0.51
ALDH1A1 P00352 2/20 0.51
KDM4E B2RXH2 1/20 0.51
RAB9A P51151 4/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
ATM Q13315 2/20 0.50
LMNA P02545 1/20 0.50
PARP1 P09874 1/20 0.48
MAPK1 P28482 2/20 0.46
NPC1 O15118 3/20 0.45
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL8622117 0.89 RXRA (0.67) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL8622118 0.89 RXRA (0.67) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL7089209 0.88 RXRA (0.61) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL8622187 0.88 RXRA (0.61) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL4427849 0.88 RXRA (0.61) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL8622185 0.88 RXRA (0.61) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL8619481 0.85 RXRA (0.59) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL7221378 0.85 RXRA (0.59) RXRARXRBRXRGMAPTALDH1A1
SCHEMBL8205297 0.82 HIF1A (0.50) RXRARXRBRXRGMAPTL3MBTL1
SCHEMBL7779845 0.82 HIF1A (0.50) RXRARXRBRXRGMAPTL3MBTL1

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
US-6114342-A 2-(O-[pyrimidin-4-yl]methylenoxy)phenylacetic acid derivatives and their use for controlling harmful fungi and animal pests BASF AKTIENGESELLSCHAFT (DE) 2000-09-05 US disclosed