SCHEMBL2391423

SCHEMBL2391423

CCOCCCCOS(C)(=O)=O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.71
KDM4E B2RXH2 1/20 0.71
USP2 O75604 1/20 0.71
ALDH1A1 P00352 1/20 0.71
LMNA P02545 1/20 0.71
MMP9 P14780 1/20 0.71
ALOX15 P16050 1/20 0.71
CA1 P00915 16/20 0.41
CA2 P00918 16/20 0.41
CA9 Q16790 14/20 0.41
CA12 O43570 4/20 0.40
CA7 P43166 4/20 0.40
CA14 Q9ULX7 4/20 0.40
CA3 P07451 3/20 0.40
CA4 P22748 3/20 0.40
CA6 P23280 3/20 0.40
CA5A P35218 3/20 0.40
CA5B Q9Y2D0 3/20 0.40
RECQL P46063 2/20 0.39
GLA P06280 1/20 0.39

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
SCHEMBL17022249 0.98 TSHR (0.68) TSHRKDM4EUSP2ALDH1A1LMNA
SCHEMBL922974 0.95 TSHR (0.64) TSHRKDM4EUSP2ALDH1A1LMNA
SCHEMBL992170 0.85 TSHR (0.55) TSHRKDM4EUSP2ALDH1A1LMNA
Busulfan SCHEMBL4373 0.84 TSHR (1.00) TSHRKDM4EUSP2ALDH1A1LMNA
Busulfan SCHEMBL4764696 0.84 TSHR (1.00) TSHRKDM4EUSP2ALDH1A1LMNA
SCHEMBL15151047 0.84 TSHR (0.68) TSHRKDM4EUSP2ALDH1A1LMNA
SCHEMBL23833996 0.83 TSHR (0.52) TSHRKDM4EUSP2ALDH1A1LMNA
SCHEMBL17022252 0.83 TSHR (0.52) TSHRKDM4EUSP2ALDH1A1LMNA
SCHEMBL5174514 0.83 TSHR (0.52) TSHRKDM4EUSP2ALDH1A1LMNA
SCHEMBL16140792 0.83 TSHR (0.52) TSHRKDM4EUSP2ALDH1A1LMNA

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-3871674-B1 USE OF ANATABINE FOR REDUCING BLOOD SERUM LEVELS OF C-REACTIVE PROTEIN IN AN INDIVIDUAL PHILIP MORRIS PRODUCTS SA (CH) 2024-12-25 EP disclosed
EP-2549995-B1 USE OF ANATABINE TO TREAT INFLAMMATION AND METHODS OF SYNTHESIZING ANATABINE PHILIP MORRIS PRODUCTS SA (CH) 2021-04-21 EP disclosed
EP-3524245-A1 USE OF ANATABINE TO TREAT INFLAMMATION AND METHODS OF SYNTHESIZING ANATABINE Philip Morris Products S.A. (CH) 2019-08-14 EP disclosed
EP-3524246-A1 USE OF ANATABINE TO TREAT INFLAMMATION AND METHODS OF SYNTHESIZING ANATABINE Philip Morris Products S.A. (CH) 2019-08-14 EP disclosed
US-8557999-B2 Pharmaceutical, dietary supplement, and food grade salts of anatabine Rock Creek Pharmaceuticals, Inc. (US) 2013-10-15 US disclosed
US-20120232115-A1 PHARMACEUTICAL, DIETARY SUPPLEMENT, AND FOOD GRADE SALTS OF ANATABINE Rock Creek Pharmaceuticals, Inc. (US) 2012-09-13 US disclosed
US-8207346-B2 Methods of synthesizing anatabine Rock Creek Pharmaceuticals, Inc. (US) 2012-06-26 US disclosed
US-20110237627-A1 METHODS OF SYNTHESIZING ANATABINE Rock Creek Pharmaceuticals, Inc. (US) 2011-09-29 US 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 (2 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-20120232115-A1 PHARMACEUTICAL, DIETARY SUPPLEMENT, AND FOOD GRADE SALTS OF ANATABINE ALKBH1, AADAT, DIMT1 TSHR 4736/4885KDM4E 972/4885USP2 4055/4885
US-20110237627-A1 METHODS OF SYNTHESIZING ANATABINE ALKBH1, ALKBH2, NME2 TSHR 4821/4885KDM4E 496/4885USP2 3754/4885

“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.