SCHEMBL4383288

SCHEMBL4383288

CC(C)(C)OC(=O)N1CCC(CN2CCN(CCCN3CCCCC3)C2=C(C#N)C#N)CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.56
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
NSD2 O96028 1/20 0.40
EHMT2 Q96KQ7 1/20 0.40
FPR2 P25090 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
LMNA P02545 1/20 0.39
TP53 P04637 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
SCHEMBL4384582 0.88 GPR119 (0.42) HRH3MEN1ALDH1A1MAPTKMT2A
SCHEMBL4386527 0.88 KDM4E (0.45) HPGDMEN1ALDH1A1MAPTKMT2A
SCHEMBL4382296 0.86 HRH3 (0.53) HRH3HPGDMEN1ALDH1A1MAPT
SCHEMBL4395383 0.83 GPR119 (0.44) FPR2GPR119
SCHEMBL4389443 0.79 HRH3 (0.64) HRH3MAPTNSD2EHMT2
SCHEMBL14401613 0.77 HRH3 (0.69) HRH3ALDH1A1MAPT
SCHEMBL13788022 0.76 HRH3 (0.74) HRH3MAPT
SCHEMBL310713 0.75 HPGD (0.60) HPGDMEN1ALDH1A1MAPTKMT2A
SCHEMBL4394477 0.75 HRH3 (1.00) HRH3MAPT
SCHEMBL4395380 0.75 HRH3 (1.00) HRH3MAPT

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-20090181948-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-07-16 US disclosed
EP-1847530-A1 DIAMINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 EP 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-20090181948-A1 DIAMINE DERIVATIVE ARG1, PRMT5, PRMT1 HRH3 452/4885HPGD 349/4885MEN1 3396/4885

“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.