SCHEMBL18080649

SCHEMBL18080649

O=C1O[C@H](CO)C(OCc2ccccc2)[C@@H]1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 2/20 0.44
▸ MTOR P42345 1/20 0.44
▸ BCHE P06276 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ TACR2 P21452 1/20 0.42
▸ SLC6A2 P23975 1/20 0.41
▸ PSEN1 P49768 3/20 0.40
▸ PSEN2 P49810 3/20 0.40
▸ APH1B Q8WW43 3/20 0.40
▸ NCSTN Q92542 3/20 0.40
▸ APH1A Q96BI3 3/20 0.40
▸ PSENEN Q9NZ42 3/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ IDO1 P14902 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ CTRB1 P17538 1/20 0.38
▸ FASN P49327 1/20 0.37
▸ CTSV O60911 1/20 0.36
▸ CTSL P07711 1/20 0.36

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
SCHEMBL22710203 0.96 BCHE (0.45) PDPK1MTORBCHEACHETACR2
SCHEMBL20741887 0.90 SLC6A2 (0.46) PDPK1MTORBCHEACHETACR2
SCHEMBL16805385 0.85 NAAA (0.43) PDPK1MTORBCHEACHETACR2
SCHEMBL18080620 0.85 NAAA (0.43) PDPK1MTORBCHEACHETACR2
SCHEMBL18497676 0.84 BCHE (0.54) PDPK1MTORBCHEACHETACR2
SCHEMBL3304205 0.84 BCHE (0.54) PDPK1MTORBCHEACHETACR2
SCHEMBL22796970 0.84 BCHE (0.54) PDPK1MTORBCHEACHETACR2
SCHEMBL14571363 0.84 BCHE (0.54) PDPK1MTORBCHEACHETACR2
SCHEMBL12896359 0.84 BCHE (0.54) PDPK1MTORBCHEACHETACR2
SCHEMBL30801101 0.84 BCHE (0.54) PDPK1MTORBCHEACHETACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 — — 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-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF POLRMT, POLN, NSUN3 PDPK1 2596/4885MTOR 4754/4885BCHE 4219/4885

“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.

Send feedback