SCHEMBL6841701

SCHEMBL6841701

C=CCOP(=O)(ON(C)C)ON(C)C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL28695270 0.79 BTN3A1 (0.36)
SCHEMBL30605 0.78 TSHR (0.38)
SCHEMBL2589130 0.75 TSHR (0.33)
SCHEMBL2557778 0.75 TSHR (0.33)
Butane SCHEMBL28193264 0.75 TSHR (0.43)
SCHEMBL1075958 0.74 LPAR2 (0.31)
SCHEMBL8746827 0.73 TSHR (0.62)
SCHEMBL45275 0.73 MEN1 (0.30)
SCHEMBL709420 0.73 TSHR (0.62)
Ammonia Solution, Strong SCHEMBL27666826 0.73 TSHR (0.32)

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-6693090-B2 OSTEOPOROSIS AVENTIS PHARMA S.A. (FR) 2004-02-17 US disclosed
US-20030073675-A1 Novel 19-norsteroids substituted in position 11beta, preparation process and intermediates, application as medicines and pharmaceutical compositions containing them AVENTIS PHARMA S.A. 2003-04-17 US disclosed
US-6479476-B1 TREATING MENOPAUSAL SYMPTOMS AND OSTEOPOROSIS IN FEMALE WARM-BLOODED ANIMALS AVENTIS PHARMA S.A. (FR) 2002-11-12 US disclosed
US-6472382-B2 OSTEOPOROSIS TREATMENT AVENTIS PHARMA S.A. (FR) 2002-10-29 US disclosed
US-6462211-B1 FOR USE IN HORMONE REPLACEMENT THERAPY, THERAPY OF OSTEOPOROSIS AVENTIS PHARMA S.A. (FR) 2002-10-08 US disclosed
US-6399766-B2 TREATING OSTEOPOROSIS; HAVING NO ENDOMETRIAL HYPERPLASIA ACTIVITY NOR BREAST TUMOR PROLIFERATION ACTIVITY AVENTIS PHARMA S.A. (FR) 2002-06-04 US disclosed
US-20020040135-A1 4-halogenated steroids, their preparation process and intermediates, their use as medicaments and the pharmaceutical compositions containing them Roussel, Hoechst 2002-04-04 US disclosed
US-20010039268-A1 New 4-halogenated steroids, their preparation process and intermediates, their use as medicaments and the pharmaceutical compositions containing them HOECHST MARION ROUSSEL 2001-11-08 US disclosed
US-20010008941-A1 New 4-halogenated steroids, their preparation process and intermediates, their use as medicaments and the pharmaceutical compositions containing them HOECHST MARION ROUSSEL 2001-07-19 US disclosed
US-20010005756-A1 New 4-halogenated steroids, their preparation process and intermediates, their use as medicaments and the pharmaceutical compositions containing them HOECHST MARION ROUSSEL 2001-06-28 US disclosed
US-6239121-B1 COMPOUNDS OTHER THAN OESTRADIOL HAVING A DISSOCIATED OESTROGEN ACTIVITY AT THE BONE LEVEL, WHILE HAVING NO OR LITTLE ENDOMETRIAL HYPERPLASIA ACTIVITY, NOR BREAST TUMOR PROLIFERATION ACTIVITY. HOECHST MARION ROUSSEL (FR) 2001-05-29 US disclosed