SCHEMBL2472482

SCHEMBL2472482

CCOC(=O)C(C)(C(=O)OCC)C1CCc2cc(OC)ccc2C1=O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP24A1 Q07973 6/20 0.50
▸ CYP26A1 O43174 3/20 0.50
▸ CYP27A1 Q02318 3/20 0.50
▸ CYP19A1 P11511 1/20 0.47
▸ ACHE P22303 5/20 0.43
▸ MPO P05164 1/20 0.43
▸ DRD2 P14416 2/20 0.43
▸ HTR2A P28223 2/20 0.43
▸ HTR2C P28335 2/20 0.43
▸ HTR2B P41595 2/20 0.43
▸ SIGMAR1 Q99720 2/20 0.43
▸ METAP1 P53582 2/20 0.42
▸ PPARG P37231 1/20 0.41

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
SCHEMBL14062029 0.92 CYP24A1 (0.49) CYP24A1CYP26A1CYP27A1CYP19A1ACHE
SCHEMBL972021 0.80 CYP24A1 (0.53) CYP24A1CYP26A1CYP27A1CYP19A1ACHE
SCHEMBL7290713 0.80 CYP24A1 (0.53) CYP24A1CYP26A1CYP27A1CYP19A1ACHE
SCHEMBL14137073 0.79 DRD2 (0.44) CYP24A1CYP26A1CYP27A1CYP19A1ACHE
SCHEMBL2805053 0.79 PPARA (0.47) DRD2PPARG
SCHEMBL17211830 0.79 PARP10 (0.39) CYP24A1CYP26A1CYP27A1ACHEMETAP1
SCHEMBL17022155 0.78 CA1 (0.47) CYP26A1CYP19A1ACHEDRD2
SCHEMBL14137074 0.78 CYP26A1 (0.46) CYP24A1CYP26A1CYP19A1
SCHEMBL19128297 0.78 CYP24A1 (0.51) CYP24A1CYP26A1CYP27A1CYP19A1ACHE
SCHEMBL14061633 0.78 CYP24A1 (0.60) CYP24A1CYP26A1CYP27A1CYP19A1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10081646-B2 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2018-09-25 — — US disclosed
US-20180002356-A1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2018-01-04 — — US disclosed
US-9708353-B2 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2017-07-18 — — US disclosed
US-9708353-B2 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2017-07-18 — — US disclosed
EP-2364089-B1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC (US) 2016-12-07 — — EP disclosed
EP-2364089-B1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC (US) 2016-12-07 — — EP disclosed
US-9181191-B2 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2015-11-10 — — US disclosed
US-9181191-B2 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2015-11-10 — — US disclosed
US-20150232492-A1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2015-08-20 — — US disclosed
US-20150232492-A1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2015-08-20 — — US disclosed
US-20140100195-A1 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN MA INC. 2014-04-10 — — US disclosed
US-8349849-B2 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN IDEC MA INC. (US) 2013-01-08 — — US disclosed
EP-2364089-A1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS Biogen Idec MA Inc. (US) 2011-09-14 — — EP disclosed
US-20100160357-A1 Heterobicyclic sphingosine 1-phosphate analogs BIOGEN MA INC. 2010-06-24 — — US disclosed
WO-2010051031-A1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN IDEC MA INC. (US) 2010-05-06 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180002356-A1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS S1PR1, S1PR2, S1PR4 CYP24A1 1594/4885CYP26A1 3735/4885CYP27A1 1199/4885
US-20150232492-A1 HETEROBICYCLIC SPHINGOSINE 1-PHOSPHATE ANALOGS S1PR1, S1PR2, S1PR4 CYP24A1 1594/4885CYP26A1 3735/4885CYP27A1 1199/4885
US-20140100195-A1 Heterobicyclic sphingosine 1-phosphate analogs S1PR1, S1PR2, S1PR4 CYP24A1 1594/4885CYP26A1 3735/4885CYP27A1 1199/4885
US-20100160357-A1 Heterobicyclic sphingosine 1-phosphate analogs S1PR1, S1PR2, S1PR4 CYP24A1 1594/4885CYP26A1 3735/4885CYP27A1 1199/4885
US-10081646-B2 Heterobicyclic sphingosine 1-phosphate analogs S1PR1, S1PR2, S1PR4 CYP24A1 1594/4885CYP26A1 3735/4885CYP27A1 1199/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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