SCHEMBL7964291

SCHEMBL7964291

NC(=O)C1CCC=CC1C(=O)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
F13A1 P00488 1/20 0.47
TGM2 P21980 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HPGD P15428 1/20 0.45
MAPT P10636 3/20 0.44
GAA P10253 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GFER P55789 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GLA P06280 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
HTT P42858 1/20 0.40
ESR2 Q92731 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ME3 Q16798 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL9804879 0.88 POLB (0.56) POLBTDP1HPGDMAPTGAA
SCHEMBL7693351 0.82 POLB (0.56) POLBTDP1HPGDMAPTGAA
Benzoyl Chloride SCHEMBL27749239 0.75 TSHR (0.35) POLBTDP1MAPTGAAL3MBTL1
SCHEMBL248183 0.74 MAPT (0.34) POLBTDP1MAPT
SCHEMBL6219581 0.74 MAPT (0.36) MAPTGRM4
SCHEMBL9946340 0.70 L3MBTL1 (0.69) POLBTDP1HPGDMAPTGAA
Benzene SCHEMBL27615459 0.70 MAPT (0.33) POLBTDP1MAPTMEN1KMT2A
Benzoyl Chloride SCHEMBL28084223 0.69 PARP1 (0.35) POLBTDP1MAPTMEN1KMT2A
SCHEMBL10337750 0.68 MAPT (0.78) POLBTDP1HPGDMAPTGAA
SCHEMBL105931 0.68 MAPT (0.78) POLBTDP1HPGDMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204222-B1 SUITABLE AS HERBICIDES AND FOR DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-20 US disclosed
US-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 US disclosed