SCHEMBL19997427

SCHEMBL19997427

OC1O[C@@H]2C(OCc3ccccc3)[C@]2(OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 6/20 0.41
▸ GRM2 Q14416 1/20 0.36
▸ GRM3 Q14832 1/20 0.36
▸ PDPK1 O15530 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ OPRM1 P35372 2/20 0.35
▸ OPRL1 P41146 2/20 0.35
▸ IDO1 P14902 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ TSHR P16473 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CYP2C19 P33261 1/20 0.33

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
SCHEMBL19412682 0.71 BCHE (0.35) BCHE
SCHEMBL24158036 0.71 BCHE (0.44) BCHEOPRM1OPRL1CYP2C19
SCHEMBL19101726 0.71 CTSV (0.39) BCHEPDPK1MTORIDO1CYP2C19
SCHEMBL18699958 0.71 PDE4D (0.38) BCHEGRM2GRM3PDPK1MTOR
SCHEMBL23047613 0.70 BCHE (0.38) BCHEOPRM1OPRL1PDE4DALDH1A1
SCHEMBL19650285 0.70 MAPT (0.38) BCHEIDO1ALDH1A1CYP2C19
SCHEMBL19962794 0.70 BCHE (0.38) BCHEGRM2GRM3PDPK1MTOR
SCHEMBL19292430 0.70 CTSV (0.38) BCHEGRM2GRM3PDPK1MTOR
SCHEMBL23278062 0.69 IDO1 (0.37) BCHEGRM2GRM3PDPK1MTOR
SCHEMBL7901242 0.68 PDPK1 (0.54) BCHEPDPK1MTORIDO1PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10988498-B2 Processes and intermediates for the preparation of 1′-substituted carba-nucleoside analogs GILEAD SCIENCES, INC. (US) 2021-04-27 — — US disclosed
US-RE46762-E1 1′-substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC (US) 2018-03-27 — — 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 (1 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-10988498-B2 Processes and intermediates for the preparation of 1′-substituted carba-nucleoside analogs PNP, TYMP, CDA BCHE 3851/4885GRM2 3501/4885GRM3 3715/4885

“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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