SCHEMBL7991209

SCHEMBL7991209

[CH2]CCC1CC=CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 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
SCHEMBL7991206 1.00 KDM4E (0.33) KDM4ETDP1ALDH1A1ALOX15
SCHEMBL7992632 0.94 ALDH1A1 (0.31) KDM4ETDP1ALDH1A1ALOX15
SCHEMBL7992356 0.88 CYP1A2 (0.33)
SCHEMBL7992364 0.88 CYP1A2 (0.33)
SCHEMBL7479466 0.85
SCHEMBL8119123 0.83 ALDH1A1 (0.32) KDM4ETDP1ALDH1A1ALOX15
SCHEMBL7994401 0.83 ALDH1A1 (0.32) KDM4ETDP1ALDH1A1ALOX15
SCHEMBL7994439 0.82 CYP1A2 (0.30)
SCHEMBL8185890 0.81 KDM4E (0.33) KDM4ETDP1ALDH1A1ALOX15
SCHEMBL8175953 0.81 KDM4E (0.33) KDM4ETDP1ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6277790-B1 APPLYING PLANTS, SEEDS, SOILS OR ENVIRONMENT BASF AKTIENGESELLSCHAFT (DE) 2001-08-21 US disclosed
EP-1003741-A1 SUBSTITUTED HERBICIDE TETRAZOLINONECARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 2000-05-31 EP disclosed
WO-1999007702-A1 SUBSTITUTED HERBICIDE TETRAZOLINONECARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 1999-02-18 WO disclosed