SCHEMBL20109352

SCHEMBL20109352

CCOC(=O)CC(=C1CCCCC1)P1(=O)N(c2ccccc2)CCN1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
NOTUM Q6P988 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ATM Q13315 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
NPC1 O15118 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
CASP3 P42574 1/20 0.35

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
SCHEMBL21866417 0.88 CASP3 (0.37) ALDH1A1MAPTGAANOTUML3MBTL1
SCHEMBL20113464 0.87 ALDH1A1 (0.35) ALDH1A1MAPTGAANOTUML3MBTL1
SCHEMBL20113436 0.87 ALDH1A1 (0.38) ALDH1A1MAPTGAANOTUML3MBTL1
SCHEMBL20109155 0.82 DRD2 (0.33) ALDH1A1MAPTL3MBTL1HTT
SCHEMBL17596725 0.79 GAA (0.40) ALDH1A1MAPTGAAL3MBTL1ATM
SCHEMBL20109270 0.78 RAB9A (0.39) ALDH1A1MAPTGAAMAPK1L3MBTL1
SCHEMBL20109323 0.78 RAB9A (0.39) ALDH1A1MAPTGAAMAPK1L3MBTL1
SCHEMBL20109325 0.76 RAB9A (0.38) ALDH1A1MAPTGAAMAPK1L3MBTL1
SCHEMBL20109330 0.76 MEN1 (0.46) ALDH1A1MAPTGAAMAPK1NPC1
SCHEMBL20109326 0.76 RAB9A (0.38) ALDH1A1MAPTGAAMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10633403-B2 N-heterocyclic phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA (US) 2020-04-28 US disclosed
US-10633403-B2 N-heterocyclic phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA (US) 2020-04-28 US disclosed
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
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 (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-20180118770-A1 N-Heterocyclic Phosphines NANP, PPIP5K2, PHPT1 ALDH1A1 4621/4885MAPT 4371/4885GAA 4181/4885
US-10633403-B2 N-heterocyclic phosphines NANP, PPIP5K2, PHPT1 ALDH1A1 4621/4885MAPT 4371/4885GAA 4181/4885

“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.