SCHEMBL9879094

SCHEMBL9879094

CC(C)OC(=O)c1cc(-n2c(=O)cc[nH]c2=O)c(F)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
HPGD P15428 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 4/20 0.34
POLB P06746 1/20 0.34
KDM4E B2RXH2 3/20 0.34
HSD17B10 Q99714 1/20 0.34
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
WDR5 P61964 1/20 0.33
PKM P14618 1/20 0.33
ADORA3 P0DMS8 1/20 0.32
PTPN11 Q06124 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL9706676 0.82 SMN1; SMN2 (0.40) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL9706690 0.81 MAPT (0.34) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL9796342 0.80 BCAT1 (0.50)
SCHEMBL10645885 0.80 MAPT (0.35) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL10644831 0.78 BCAT2 (0.33) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL9706691 0.78 MAPT (0.34) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL10530802 0.78 BCAT1 (0.41) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL24152095 0.78 LMNA (0.38) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL9706686 0.78 ALDH1A1 (0.35) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL9706535 0.78 ALDH1A1 (0.35) LMNAHPGDMAPTSMN1; SMN2ALDH1A1

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-5017211-A Herbicides CIBA-GEIGY CORPORATION (US) 1991-05-21 US disclosed