SCHEMBL7759002

SCHEMBL7759002

CC1COP(=O)(Cc2ccc(N)cc2)OC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
GFER P55789 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.32
CYP19A1 P11511 1/20 0.31
LMNA P02545 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
SCHEMBL8641309 0.80 ALDH1A1 (0.39) ALDH1A1GFERCYP3A4TSHRTDP1
SCHEMBL2029431 0.77 ALDH1A1 (0.37) ALDH1A1GFERCYP3A4TSHRTDP1
SCHEMBL7752127 0.77 ALDH1A1 (0.37) ALDH1A1GFERCYP3A4TSHRTDP1
SCHEMBL7756402 0.77 ALDH1A1 (0.33) ALDH1A1GFERCYP3A4TSHRTDP1
SCHEMBL7753011 0.77 GFER (0.33) ALDH1A1GFERCYP3A4TSHRTDP1
SCHEMBL7752991 0.73 POLB (0.31) ALDH1A1GFERCYP3A4TSHRTDP1
SCHEMBL7755590 0.68 MAPT (0.37) CYP19A1
SCHEMBL8641317 0.66 ALDH1A1 (0.39) ALDH1A1GFERCYP3A4TSHRTDP1
4,4'-Methylenedianiline SCHEMBL7632512 0.65 ALDH1A1 (0.61) ALDH1A1GFERCYP3A4TSHRTDP1
SCHEMBL7753020 0.64 ALDH1A1 (0.34) ALDH1A1GFERCYP3A4TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0769015-B1 PHOSPHONIC ACID COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-03-14 EP disclosed
EP-0625522-B1 Benzopyran derivatives and their use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-08-19 EP disclosed
US-5741784-A ADMINISTERING TO TREAT METABOLIC BONE DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-04-21 US disclosed
US-5716944-A USEFUL AS PROPHYLACTIC AND THERAPEUTIC AGENTS OF VARIOUS METABOLIC BONE DISEASES SUCH AS OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-10 US disclosed
EP-0769015-A1 PHOSPHONIC ACID COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-04-23 EP disclosed
US-5580863-A TREATMENT OF OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-03 US disclosed
WO-1996001267-A1 PHOSPHONIC ACID COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-01-18 WO disclosed
EP-0625522-A1 Benzopyran derivatives and their use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-11-23 EP disclosed