SCHEMBL20109359

SCHEMBL20109359

C=C=C(Cc1ccc(C)cc1)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTBP2 P56545 1/20 0.42
DHODH Q02127 1/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
ACHE P22303 1/20 0.42
HPGD P15428 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FFAR1 O14842 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL20109336 0.89 MEN1 (0.49) KMT2AMEN1SMN1; SMN2CES2CES1
SCHEMBL20109333 0.89 ALDH1A1 (0.49) KMT2AMEN1SMN1; SMN2CES2CES1
SCHEMBL20109356 0.88 MAPT (0.47) GAASMN1; SMN2CTBP2TDP1L3MBTL1
SCHEMBL20109358 0.88 KMT2A (0.48) KMT2AMEN1GAASMN1; SMN2CTBP2
SCHEMBL10047307 0.83 CTBP2 (0.51) KMT2AMEN1GAASMN1; SMN2CTBP2
SCHEMBL20109355 0.83 LMNA (0.50) KMT2AMEN1GAASMN1; SMN2ALDH1A1
SCHEMBL7696584 0.78 KMT2A (0.50) KMT2AMEN1GAAHTTSMN1; SMN2
SCHEMBL7641457 0.78 KMT2A (0.53) KMT2AMEN1GAAHTTSMN1; SMN2
SCHEMBL15964600 0.75 KMT2A (0.48) KMT2AMEN1GAAHTTSMN1; SMN2
SCHEMBL25883428 0.74 KMT2A (0.43) KMT2AMEN1GAAHTTSMN1; SMN2

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 KMT2A 2508/4885MEN1 469/4885GAA 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.