SCHEMBL20109203

SCHEMBL20109203

C=C(CP(C)(=O)c1ccccc1)P1(=O)SCCS1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.34
ESR1 P03372 1/20 0.34
POLB P06746 1/20 0.33
CFTR P13569 1/20 0.33
TSHR P16473 4/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA5A P35218 1/20 0.32
MEN1 O00255 3/20 0.31
ALDH1A1 P00352 3/20 0.31
KMT2A Q03164 3/20 0.31
GAA P10253 2/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
HTT P42858 1/20 0.31
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 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
SCHEMBL20113728 0.85 USP2 (0.47) USP2POLBCFTRCA2CA4
SCHEMBL20109179 0.77 ALDH1A1 (0.35) USP2ESR1POLBCFTRTSHR
SCHEMBL20109151 0.73 HTT (0.34) USP2ESR1POLBCFTRTSHR
SCHEMBL20109232 0.70 HTT (0.33) USP2ESR1POLBTSHRMEN1
SCHEMBL20109255 0.70 HTT (0.33) USP2ESR1POLBTSHRMEN1
SCHEMBL16213890 0.65 TSHR (0.57) USP2ESR1POLBCFTRTSHR
SCHEMBL16213895 0.65 TSHR (0.57) USP2ESR1POLBCFTRTSHR
SCHEMBL16213896 0.65 TSHR (0.57) USP2ESR1POLBCFTRTSHR
SCHEMBL3946959 0.64 ESR1 (0.45) USP2ESR1CFTRTSHRCA2
SCHEMBL16213894 0.61 ALDH1A1 (0.55) ESR1CFTRTSHRCA2CA4

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 USP2 4368/4885ESR1 3681/4885POLB 3495/4885

“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.