SCHEMBL7617154

SCHEMBL7617154

CC1(C)CCS(=O)(=O)c2c1ccc(C(=O)C1=C(Sc3ccccc3)CCCC1=O)c2Cl

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.33
CDC25A P30304 1/20 0.33
CDC25B P30305 1/20 0.33
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 1/20 0.30
CXCR2 P25025 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
SCHEMBL7617162 0.93 RARB (0.30) RARBRARGRXRARXRBRXRG
SCHEMBL7626160 0.85
SCHEMBL7624180 0.83 RXRA (0.30) RXRA
SCHEMBL7618992 0.80
SCHEMBL7617163 0.80 PTPN1 (0.30) PTPN1CDC25ACDC25B
SCHEMBL7626100 0.77
SCHEMBL7622941 0.76
SCHEMBL7629271 0.75 LOX (0.32)
SCHEMBL7621921 0.73 RXRA (0.39) RARBRARGRXRARXRBRXRG
SCHEMBL7617111 0.71 HPD (0.33)

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-6440899-B1 CROP HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-08-27 US disclosed