SCHEMBL9816795

SCHEMBL9816795

CC(C)c1ccccc1NC(=O)N(C)C

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
POLB P06746 1/20 0.51
RECQL P46063 1/20 0.50
NLRP3 Q96P20 1/20 0.49
KMT2A Q03164 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LPAR1 Q92633 1/20 0.47

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
SCHEMBL30761772 0.82 ALDH1A1 (0.56) RECQL
SCHEMBL7089269 0.82 ALDH1A1 (0.56) RECQL
SCHEMBL2341773 0.81 MAPT (0.58) MAPTRECQLNLRP3KMT2ACA12
SCHEMBL20540474 0.80 KMT2A (0.57) KMT2ALPAR1
SCHEMBL30271312 0.79 GRIN2D (0.60) MAPTRECQLNLRP3KMT2ACA12
SCHEMBL2091666 0.79 MAPT (0.57) MAPTRECQLNLRP3KMT2ACA12
SCHEMBL1612564 0.79 MAPT (0.57) MAPTRECQLNLRP3KMT2ACA12
SCHEMBL757161 0.79 MAPT (0.57) MAPTPOLBRECQLNLRP3KMT2A
SCHEMBL1520489 0.79 GRIN2D (0.60) MAPTRECQLNLRP3KMT2ACA12
SCHEMBL7202775 0.78 TP53 (0.59)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1094569-A The herbicidal composition and the herbicidal methods thereof that are used for mountain farming NIHON NOHYAKU CO LTD (JP) 1994-11-09 CN disclosed
EP-0135714-B1 SUSTAINED RELEASE COMPOSITIONS FOR BIOLOGICALLY ACTIVE MATERIALS MELAMINE CHEMICALS, INC. (US) 1991-11-06 EP disclosed
EP-0348314-A1 Synergistic herbicidal mixture based on bifenox and benzoic acids with an imidazolinyl group RHONE-POULENC AGROCHIMIE (FR) 1989-12-27 EP disclosed
US-4659366-A 2-(alkoximinoalkoxycarbonyl)-phenylsulphonylurea herbicides and fungicides BAYER AKTIENGESELLSCHAFT (DE) 1987-04-21 US disclosed
US-3933471-A N-4-ISOPROPYLPHENYL-N', N'-DIMETHYLUREA AND 2,4-DINITRO-6-TERT-BUTYLPHENOL OR SALTS PEPRO, SOCIETE POUR LE DEVELOPMENT ET LA VENTE DE SPECIALITES (FR) 1976-01-20 US disclosed