SCHEMBL7960938

SCHEMBL7960938

COC(=O)C(C)CNC(=O)Cc1c(C)cc(C)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 2/20 0.40
KMT2A Q03164 2/20 0.39
HPGD P15428 2/20 0.37
RXFP1 Q9HBX9 3/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
TACR1 P25103 2/20 0.34

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
SCHEMBL7960039 0.90 LPAR1 (0.40) LPAR1KMT2AHPGDRXFP1LMNA
SCHEMBL7960616 0.83 HPGD (0.43) KMT2AHPGDLMNAALDH1A1
SCHEMBL7961970 0.82 MEN1 (0.43) LPAR1KMT2ARXFP1LMNATAS1R3
SCHEMBL6990018 0.82 MEN1 (0.43) LPAR1KMT2ARXFP1LMNATAS1R3
SCHEMBL7950138 0.80 TAS1R3 (0.44) LPAR1RXFP1LMNAALDH1A1MAPT
SCHEMBL6993048 0.80 TAS1R3 (0.44) LPAR1RXFP1LMNAALDH1A1MAPT
SCHEMBL6990895 0.79 TAS1R3 (0.55) TAS1R3TAS1R1
SCHEMBL7959631 0.79 TAS1R3 (0.55) TAS1R3TAS1R1
SCHEMBL7950079 0.78 ALDH1A1 (0.45) LPAR1KMT2ARXFP1LMNAALDH1A1
SCHEMBL6998473 0.78 ALDH1A1 (0.45) LPAR1KMT2ARXFP1LMNAALDH1A1

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-6172255-B1 INSECTICIDES; MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-01-09 US disclosed
US-5830826-A Alkoxy-alkyl-substituted 1H-3-aryl-pyrrolidine-2, 4-diones used as herbicicides and pesticides BAYER AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed