SCHEMBL17364280

SCHEMBL17364280

CC(=O)OC1O[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H](OC(C)=O)[C@H]1OC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
LMNA P02545 2/20 0.47
KMT2A Q03164 1/20 0.43
CYP2D6 P10635 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40
THRB P10828 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PAX8 Q06710 1/20 0.39
PRKCA P17252 1/20 0.39
AKT1 P31749 1/20 0.39
PTK2 Q05397 1/20 0.39
P4HB P07237 2/20 0.38
PDIA4 P13667 2/20 0.38
PDIA3 P30101 2/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL13866334 1.00 TSHR (0.47) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL14176116 1.00 TSHR (0.47) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL18512780 0.91 LMNA (0.43) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL18503487 0.90 LMNA (0.40) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL13866335 0.89 TSHR (0.46) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL14176117 0.89 TSHR (0.46) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL14176115 0.89 TSHR (0.46) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL13866336 0.89 TSHR (0.46) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL17198439 0.89 LMNA (0.39) TSHRLMNAKMT2ACYP2D6ALDH1A1
SCHEMBL17198604 0.89 TSHR (0.46) TSHRLMNAKMT2ACYP2D6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112724180-B Preparation method of beta-nicotinamide mononucleotide 黄冈鲁班药业股份有限公司 2023-01-10 CN disclosed
CN-112724180-A Preparation method of beta-nicotinamide mononucleotide 黄冈鲁班药业股份有限公司 2021-04-30 CN disclosed
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 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-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods PNP, ATIC, NT5C3B TSHR 3393/4885LMNA 1004/4885KMT2A 3662/4885

“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.