SCHEMBL18871964

SCHEMBL18871964

COCC(C)N1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 5/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
HRH1 P35367 1/20 0.36
SYK P43405 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
ACHE P22303 1/20 0.34
GAA P10253 1/20 0.33
KDM1A O60341 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL16706206 0.87 KMT2A (0.41) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL8980000 0.84 KMT2A (0.44) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL24352758 0.81 KMT2A (0.41) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL14435195 0.79 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL6513116 0.79 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL30920971 0.79
SCHEMBL14435196 0.79 KMT2A (0.42) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL15305804 0.79 KMT2A (0.37) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL18872254 0.78 KMT2A (0.40) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL1603294 0.77 TSHR (0.43) KMT2AMEN1ALDH1A1LMNAHPGD

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
EP-3159341-B1 PYRIDINO[1,2-A]PYRIMIDONE ANALOGUE USED AS PI3K INHIBITOR CHAI TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2019-08-21 EP disclosed
US-20170137420-A1 PYRIDINO[1,2-A]PYRIMIDONE ANALOGUE USED AS P13K INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2017-05-18 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-20170137420-A1 PYRIDINO[1,2-A]PYRIMIDONE ANALOGUE USED AS P13K INHIBITOR PIK3CA, PIK3CD, PIP5K1B KMT2A 1648/4885MEN1 1072/4885ALDH1A1 1052/4885

“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.