SCHEMBL3474604

SCHEMBL3474604

CC1(CCC(=O)Cl)OCCO1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
ALDH1A1 P00352 2/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL3154691 0.82 ALDH1A1 (0.41) ALDH1A1
SCHEMBL203099 0.80 LMNA (0.39) TSHRALDH1A1
SCHEMBL11538765 0.78 SMN1; SMN2 (0.31)
SCHEMBL19759001 0.75 ALDH1A1 (0.39) ALDH1A1
SCHEMBL7847493 0.75 TSHR (0.46) TSHRALDH1A1
SCHEMBL20708377 0.75 LMNA (0.39) ALDH1A1
SCHEMBL11076777 0.74 ALDH1A1 (0.38) ALDH1A1
SCHEMBL24465045 0.74
SCHEMBL11245204 0.72 LMNA (0.40) TSHRALDH1A1
SCHEMBL135497 0.72 LMNA (0.44) TSHRALDH1A1

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
US-20100048654-A1 USE OF VALSARTAN OR ITS METABOLITE TO IN HIBIT PLATELET AGGREGATION NOVARTIS PHARMACEUTICALS CORPORATION 2010-02-25 US disclosed
EP-1505965-B1 USE OF THE METABOLITE OF VALSARTAN TO INHIBIT PLATELET AGGREGATION NOVARTIS AG (CH) 2006-08-02 EP disclosed
US-20050197372-A1 Use of valsartan or its metabolite to inhibit platelet aggregation MALININ ALEX (US) 2005-09-08 US disclosed
EP-1505965-A1 USE OF VALSARTAN OT ITS METABOLITE TO INHIBIT PLATELET AGGREGATION Novartis AG (CH) 2005-02-16 EP disclosed
WO-2003094915-A1 USE OF VALSARTAN OT ITS METABOLITE TO INHIBIT PLATELET AGGREGATION NOVARTIS AG (CH) 2003-11-20 WO 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 (2 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-20100048654-A1 USE OF VALSARTAN OR ITS METABOLITE TO IN HIBIT PLATELET AGGREGATION PDGFRA, PLAT, PTAFR TSHR 2190/4885ALDH1A1 796/4885TP53 4336/4885
US-20050197372-A1 Use of valsartan or its metabolite to inhibit platelet aggregation PTAFR, PDGFRA, ACE TSHR 1330/4885ALDH1A1 1036/4885TP53 4355/4885

“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.