SCHEMBL20113630

SCHEMBL20113630

CCCC/C(CC)=C(\CC(=O)OCC)P1(=N)N(c2ccccc2)CCN1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.34
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PLA2G1B P04054 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
NAMPT P43490 1/20 0.34
ALOX5 P09917 1/20 0.33
ATM Q13315 1/20 0.33
P2RX3 P56373 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NOTUM Q6P988 1/20 0.33

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
SCHEMBL20109338 0.88 GAA (0.34) GAAMAPTALDH1A1LMNAPLA2G1B
SCHEMBL20113435 0.87 MAPT (0.36) GAAMAPTALDH1A1LMNAPLA2G1B
SCHEMBL20109246 0.84 LMNA (0.33) MAPTLMNAPLA2G1BTSHRKMT2A
SCHEMBL20109251 0.81 GAA (0.39) GAAMAPTALDH1A1TSHRKMT2A
SCHEMBL20113532 0.78 MAPT (0.40) GAAMAPTALDH1A1LMNAKMT2A
SCHEMBL20113527 0.77 RAB9A (0.39) GAAMAPTALDH1A1KMT2ANPSR1
SCHEMBL20113533 0.77 RAB9A (0.39) GAAMAPTALDH1A1KMT2ANPSR1
SCHEMBL20109143 0.74 ABL1 (0.35) MAPTALDH1A1LMNAPLA2G1BTSHR
SCHEMBL20113544 0.74 RAB9A (0.37) GAAMAPTALDH1A1KMT2ANPSR1
SCHEMBL20113529 0.74 MEN1 (0.45) GAAMAPTALDH1A1KMT2ANPSR1

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 GAA 4181/4885MAPT 4371/4885ALDH1A1 4621/4885
US-10633403-B2 N-heterocyclic phosphines NANP, PPIP5K2, PHPT1 GAA 4181/4885MAPT 4371/4885ALDH1A1 4621/4885

“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.