SCHEMBL8479846

SCHEMBL8479846

Cc1cc(C)c(-c2c(O)c(Cl)c(C(C)(C)C)oc2=O)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.35
ADORA3 P0DMS8 1/20 0.35
CSNK2A2 P19784 2/20 0.35
CSNK2B P67870 2/20 0.35
CSNK2A1 P68400 2/20 0.35
ALDH1A1 P00352 2/20 0.33
CA2 P00918 2/20 0.33
POLB P06746 1/20 0.33
TYR P14679 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ESR1 P03372 3/20 0.31
ESR2 Q92731 3/20 0.31
HTT P42858 1/20 0.31
HPGD P15428 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
GLA P06280 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
SCHEMBL8479212 0.83 CYP2C9 (0.32) ACLYADORA3CSNK2A2CSNK2BCSNK2A1
SCHEMBL8482317 0.79 KDM4E (0.36) ADORA3ALDH1A1POLBSMN1; SMN2HTT
SCHEMBL8476247 0.73 CSNK2A2 (0.46) ADORA3CSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL8316423 0.71 ALOX15 (0.41) CSNK2A2CSNK2BCSNK2A1ALDH1A1CA2
SCHEMBL7219386 0.68 MAPT (0.46) ADORA3CSNK2A2CSNK2BCSNK2A1ALDH1A1
SCHEMBL12401973 0.66 MEN1 (0.46) ALDH1A1POLBSMN1; SMN2ESR1ESR2
SCHEMBL16485457 0.65 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2ESR1ESR2HTT
SCHEMBL8312960 0.64 RXFP1 (0.39) ALDH1A1ESR1ESR2HPGDKDM4E
SCHEMBL8479013 0.63 ALDH1A1 (0.35) ALDH1A1POLBSMN1; SMN2ESR1ESR2
SCHEMBL8318173 0.62 MAPT (0.45) ALDH1A1CA2SMN1; SMN2HPGDKDM4E

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-5977029-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1999-11-02 US disclosed