SCHEMBL7144537

SCHEMBL7144537

O=C(OC[C@@H](O)C[C@@H](O)CO)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.64
ADRB2 P07550 11/20 0.59
ADRB1 P08588 11/20 0.59
ADRB3 P13945 11/20 0.59
PRKCA P17252 1/20 0.55
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 1/20 0.47
KMT2A Q03164 2/20 0.47
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.46
SLC1A5 Q15758 1/20 0.45

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
SCHEMBL1866116 0.91 ALDH1A1 (0.70) ALDH1A1ADRB2ADRB1ADRB3PRKCA
SCHEMBL1866113 0.91 ALDH1A1 (0.70) ALDH1A1ADRB2ADRB1ADRB3PRKCA
SCHEMBL3391 0.91 ALDH1A1 (0.70) ALDH1A1ADRB2ADRB1ADRB3PRKCA
SCHEMBL20515564 0.90 ALDH1A1 (0.68) ALDH1A1ADRB2ADRB1ADRB3PRKCA
Benzoic Acid SCHEMBL7688676 0.87 ALDH1A1 (0.64) ALDH1A1ADRB2ADRB1ADRB3PRKCA
Benzoic Acid SCHEMBL9956241 0.87 ALDH1A1 (0.64) ALDH1A1ADRB2ADRB1ADRB3PRKCA
Benzoic Acid SCHEMBL28388934 0.87 ALDH1A1 (0.64) ALDH1A1ADRB2ADRB1ADRB3PRKCA
Benzoic Acid SCHEMBL136510 0.87 ALDH1A1 (0.64) ALDH1A1ADRB2ADRB1ADRB3PRKCA
Acetic Acid SCHEMBL28698833 0.87 ALDH1A1 (0.64) ALDH1A1ADRB2ADRB1ADRB3PRKCA
SCHEMBL14058512 0.86 ALDH1A1 (0.47) ALDH1A1ADRB2ADRB1ADRB3PRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027359-B9 MONOCYCLIC L-NUCLEOSIDES, ANALOGS AND USES THEREOF RIBAPHARM INC (US) 2003-09-17 EP disclosed
EP-1027359-B1 MONOCYCLIC L-NUCLEOSIDES, ANALOGS AND USES THEREOF RIBAPHARM INC (US) 2003-04-23 EP disclosed
US-6552183-B1 Moncyclic L-nucleosides analogs ICN PHARMACEUTICALS, INC. 2003-04-22 US disclosed
EP-1302474-A1 Monocyclic L-nucleosides, analogs and uses thereof Ribapharm, Inc. (US) 2003-04-16 EP disclosed
US-20030018186-A1 Monocyclic L-nucleosides, analogs and uses thereof BAUSCH HEALTH COMPANIES INC. (CA) 2003-01-23 US disclosed
EP-1254911-A1 Monocyclic L-nucleosides, analogs and uses thereof ICN Pharmaceuticals, Inc. (US) 2002-11-06 EP 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-20030018186-A1 Monocyclic L-nucleosides, analogs and uses thereof PNP, TYMP, SLC29A1 ALDH1A1 592/4885ADRB2 3318/4885ADRB1 2648/4885

“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.