SCHEMBL9988385

SCHEMBL9988385

O=C(CCCl)N1CCN(c2ccccc2)CC1

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.76
LMNA P02545 1/20 0.76
NPSR1 Q6W5P4 1/20 0.76
HTR7 P34969 5/20 0.69
HTR1A P08908 5/20 0.69
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
NPC1 O15118 3/20 0.64
RAB9A P51151 3/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
ALDH1A1 P00352 3/20 0.64
HSD17B10 Q99714 1/20 0.61
GFER P55789 1/20 0.60
ATM Q13315 1/20 0.60

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
SCHEMBL10976043 0.90 MAPT (0.82) MAPTLMNANPSR1HTR7HTR1A
SCHEMBL30528252 0.90 MAPT (0.86) MAPTLMNANPSR1HTR7HTR1A
SCHEMBL3299369 0.86 MAPT (0.70) MAPTLMNANPSR1HTR7HTR1A
SCHEMBL9987526 0.85 KMT2A (0.68) MAPTLMNAHTR7HTR1AMEN1
SCHEMBL28135156 0.85 MAPT (0.78) MAPTLMNANPSR1HTR7HTR1A
SCHEMBL27786793 0.85 MAPT (0.78) MAPTLMNANPSR1HTR7HTR1A
SCHEMBL4352910 0.84 MEN1 (0.79) MAPTNPSR1HTR7HTR1AMEN1
SCHEMBL12047642 0.84 MAPT (0.61) MAPTLMNANPSR1HTR7HTR1A
SCHEMBL8210319 0.83 MAPT (0.76) MAPTLMNANPSR1HTR7HTR1A
SCHEMBL12282092 0.83 MAPT (0.76) MAPTLMNANPSR1HTR7HTR1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383631-B2 1,6-disubstituted-3-amino-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-C]pyridin-7-one compounds and preparation thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-02-26 US disclosed
US-20110319619-A1 NOVEL 1,6-DISUBSTITUTED-3-AMINO-4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[3,4-C]PYRIDIN-7-ONE COMPOUNDS AND PREPARATION THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-12-29 US disclosed
US-3933824-A Piperazinobutyrophenone derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-20 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-20110319619-A1 NOVEL 1,6-DISUBSTITUTED-3-AMINO-4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[3,4-C]PYRIDIN-7-ONE COMPOUNDS AND PREPARATION THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, THPO, PLEC MAPT 1257/4885LMNA 1772/4885NPSR1 4566/4885

“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.