SCHEMBL9004230

SCHEMBL9004230

CCN(CC)C(=O)C(CC)(CC)P(=O)(O)O

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.46
MMP2 P08253 2/20 0.46
MMP3 P08254 2/20 0.46
MMP8 P22894 2/20 0.46
LMNA P02545 2/20 0.38
FDPS P14324 3/20 0.32
MLYCD O95822 1/20 0.32
RECQL P46063 1/20 0.31

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
SCHEMBL10850693 0.80 MMP1 (0.53) MMP1MMP2MMP3MMP8FDPS
SCHEMBL578487 0.80 FDPS (0.33) MMP1MMP2MMP3MMP8FDPS
SCHEMBL18486528 0.77 GGPS1 (0.52) FDPS
SCHEMBL9070271 0.77 GGPS1 (0.52) FDPS
SCHEMBL6614297 0.74
SCHEMBL18486699 0.72 MMP1 (0.41) MMP1MMP2MMP3MMP8LMNA
SCHEMBL6051813 0.72 FDPS (0.37) MMP1MMP2MMP3MMP8LMNA
SCHEMBL3281290 0.72 FDPS (0.37) MMP1MMP2MMP3MMP8LMNA
SCHEMBL282438 0.72 FDPS (0.37) LMNAFDPS
SCHEMBL10424196 0.71 CYP3A4 (0.38) MMP1MMP2MMP3MMP8LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5543406-A TREATING ANDROGEN RESPONSIVE OR MEDIATED DISEASE GLAXO WELLCOME, INC. (US) 1996-08-06 US disclosed
EP-0641356-A1 INHIBITORS OF 5-ALPHA-TESTOSTERONE REDUCTASE GLAXO WELLCOME INC. (US) 1995-03-08 EP disclosed
WO-1993013124-A1 INHIBITORS OF 5-ALPHA-TESTOSTERONE REDUCTASE GLAXO INC. (US) 1993-07-08 WO disclosed
US-4564477-A DOLICHOL INTERMEDIATE KURARAY CO., LTD. (JP) 1986-01-14 US disclosed
EP-0087136-B1 NOVEL POLYPRENYL COMPOUNDS, METHOD OF PRODUCING THE SAME AND THEIR USE IN DOLICHOL PRODUCTION KURARAY CO., LTD. (JP) 1985-07-31 EP disclosed
EP-0087136-A2 Novel polyprenyl compounds, method of producing the same and their use in dolichol production KURARAY CO., LTD. (JP) 1983-08-31 EP disclosed
US-4388237-A NEUROLEPTIC, SEDATIVE, HYPNOTIC, ANALGESIC, ANTIDEPRESSANT BASF AKTIENGESELLSCHAFT (DE) 1983-06-14 US disclosed
EP-0019172-A1 6-Substituted 11-alkylene-morphantridines, process for preparing them and pharmaceutical compositions containing them BASF Aktiengesellschaft (DE) 1980-11-26 EP disclosed
US-4172146-A Substituted phenyl derivatives CIBA-GEIGY CORPORATION (US) 1979-10-23 US disclosed
US-4069344-A INSECTICIDAL SUBSTITUTED PHENYL DERIVATIVES CIBA-GEIGY CORPORATION (US) 1978-01-17 US disclosed
US-3983243-A INSECTICIDES HOFFMANN-LA ROCHE INC. (US) 1976-09-28 US disclosed