SCHEMBL20113436

SCHEMBL20113436

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

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
MAPT P10636 5/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
HIF1A Q16665 1/20 0.36
GAA P10253 3/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NOTUM Q6P988 1/20 0.35
LMNA P02545 1/20 0.35
ATM Q13315 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
SCHEMBL20109352 0.87 ALDH1A1 (0.36) ALDH1A1MAPTL3MBTL1GAANPC1
SCHEMBL21866417 0.87 CASP3 (0.37) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL20113464 0.86 ALDH1A1 (0.35) ALDH1A1MAPTL3MBTL1GAANPC1
SCHEMBL20113904 0.82 MAPT (0.39) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL20109229 0.81 DRD2 (0.33) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL20113893 0.79 RAB9A (0.39) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL20113907 0.79 RAB9A (0.39) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL20109227 0.77 GAA (0.39) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL20113894 0.77 RAB9A (0.37) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL20113906 0.77 MEN1 (0.45) ALDH1A1MAPTKDM4EMEN1KMT2A

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 2 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-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 4371/4885KDM4E 3603/4885
US-10633403-B2 N-heterocyclic phosphines NANP, PPIP5K2, PHPT1 ALDH1A1 4621/4885MAPT 4371/4885KDM4E 3603/4885

“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.