SCHEMBL20109196

SCHEMBL20109196

CCCC/C(CC)=C(\CC)P1(=O)SCCS1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31

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
SCHEMBL20109171 0.71 CES2 (0.31) CES2CES1
SCHEMBL346418 0.63 CES1 (0.45) CES2CES1
Ethylene Glycol SCHEMBL10986319 0.62 ALDH1A1 (0.45) CES2CES1
SCHEMBL28546562 0.60 CES1 (0.53) CES2CES1
SCHEMBL453159 0.60 CES1 (0.41) CES2CES1
SCHEMBL10474453 0.60 CES1 (0.42) CES2CES1
SCHEMBL27912995 0.60 CES1 (0.41) CES2CES1
SCHEMBL22092201 0.58 CES1 (0.46) CES2CES1
Ammonia Solution, Strong SCHEMBL4627589 0.58 CES1 (0.50) CES2CES1
SCHEMBL4791139 0.57 CES2 (0.48) CES2CES1

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-20180118770-A1 N-Heterocyclic Phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2018-05-03 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-20180118770-A1 N-Heterocyclic Phosphines NANP, PPIP5K2, PHPT1 CES2 2807/4885CES1 3917/4885

“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.