SCHEMBL2404922

SCHEMBL2404922

O=C(Oc1c(F)c(F)c(F)c(F)c1F)C1=CCC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.33
CHRM3 P20309 2/20 0.31
LMNA P02545 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
THRB P10828 1/20 0.30
CHRM1 P11229 1/20 0.30

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
SCHEMBL8183007 0.73
SCHEMBL43992 0.72
SCHEMBL11578150 0.71 PTPN1 (0.36) PTPN1CHRM3LMNACHRM2CHRM4
SCHEMBL5280889 0.71
SCHEMBL5889497 0.70 SENP1 (0.47)
SCHEMBL26103828 0.70 MAPT (0.46) LMNA
SCHEMBL16322420 0.69 MAPK1 (0.38) LMNA
SCHEMBL8838122 0.68 ALDH1A1 (0.39) PTPN1CHRM3LMNACHRM2CHRM4
SCHEMBL43932 0.68
SCHEMBL1481724 0.67

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
US-8795647-B2 Alternating ring-opening metathesis polymerization THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2014-08-05 US disclosed
US-20110212046-A1 ALTERNATING RING-OPENING METATHESIS POLYMERIZATION THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2011-09-01 US disclosed
WO-2010022284-A1 ALTERNATING RING-OPENING METATHESIS POLYMERIZATION THE RESEARCH FOUNDATION OF THE STATE UNIVERSITY OF NEW YORK (US) 2010-02-25 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 (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-20110212046-A1 ALTERNATING RING-OPENING METATHESIS POLYMERIZATION PARG, PIN1, PARP4 PTPN1 4406/4885CHRM3 4145/4885LMNA 4529/4885

“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.