SCHEMBL18896702

SCHEMBL18896702

c1ccc(COC[C@H]2OC[C@@H](OCc3ccccc3)[C@@H]2OCc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.55
ACHE P22303 2/20 0.55
SLC6A2 P23975 2/20 0.49
PDE4D Q08499 1/20 0.44
HTR1A P08908 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
GJB2 P29033 2/20 0.40
NT5E P21589 1/20 0.40
TSHR P16473 1/20 0.40
LMNA P02545 1/20 0.40
SSTR1 P30872 1/20 0.39
SSTR2 P30874 1/20 0.39
SSTR4 P31391 1/20 0.39
SSTR3 P32745 1/20 0.39
SSTR5 P35346 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
SCHEMBL18640660 1.00 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL18852547 1.00 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL22316285 1.00 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL17040223 1.00 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL29937530 1.00 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL19380966 1.00 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL20140085 0.97 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL18485164 0.97 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL19891743 0.97 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A
SCHEMBL18822660 0.97 BCHE (0.55) BCHEACHESLC6A2PDE4DHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3184112-B1 SYNTHETIC INTERMEDIATE OF 1-(2-DEOXY-2-FLUORO-4-THIO-ß-D-ARABINOFURANOSYL)CYTOSINE FUJIFILM CORP (JP) 2020-12-23 EP disclosed
US-10597414-B2 Crystalline polymorphic form of 3-hydroxy-4,5-bis-benzyloxy-6-benzyloxymethyl-2-phenyl-2-OXO-2λ5-[1,2]oxaphosphinane PHOST'IN (FR) 2020-03-24 US disclosed
US-10570112-B2 Synthetic intermediate of 1-(2-deoxy-2-fluoro-4-thio-β-D-arabinofuranosyl)cytosine, synthetic intermediate of thionucleoside, and method for producing the same FUJIFILM CORPORATION (JP) 2020-02-25 US disclosed
US-20190330252-A1 CRYSTALLINE POLYMORPHIC FORM OF 3-HYDROXY-4,5-BIS-BENZYLOXY-6-BENZYLOXYMETHYL-2-PHENYL-2-0X0-2LAMBDA5-[l ,2]0XAPHOSPHINANE PHOST'IN (FR) 2019-10-31 US disclosed
US-9663548-B2 10-α/β-D-arabinofuranosyl-undecenes as potential anti-mycobacterial agents and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2017-05-30 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 (3 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-10570112-B2 Synthetic intermediate of 1-(2-deoxy-2-fluoro-4-thio-β-D-arabinofuranosyl)cytosine, synthetic intermediate of thionucleoside, and method for producing the same TYMS, TYMP, RRM2B BCHE 3683/4885ACHE 3475/4885SLC6A2 2644/4885
US-20190330252-A1 CRYSTALLINE POLYMORPHIC FORM OF 3-HYDROXY-4,5-BIS-BENZYLOXY-6-BENZYLOXYMETHYL-2-PHENYL-2-0X0-2LAMBDA5-[l ,2]0XAPHOSPHINANE CYP3A5, CYP4B1, SF3B5 BCHE 2549/4885ACHE 4782/4885SLC6A2 2369/4885
US-10597414-B2 Crystalline polymorphic form of 3-hydroxy-4,5-bis-benzyloxy-6-benzyloxymethyl-2-phenyl-2-OXO-2λ5-[1,2]oxaphosphinane IPO5, SF3B5, CYP3A5 BCHE 2890/4885ACHE 4774/4885SLC6A2 2863/4885

“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.