SCHEMBL22496974

SCHEMBL22496974

CCN(CC)CCc1n[nH]cc1N

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.35
HTR6 P50406 1/20 0.35
HRH3 Q9Y5N1 3/20 0.33
HRH4 Q9H3N8 2/20 0.33
HTR1D P28221 1/20 0.32
MPO P05164 1/20 0.32
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
MAOA P21397 1/20 0.31
HTR3A P46098 1/20 0.31
BLM P54132 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL22572959 0.81 HTR2A (0.33) HTR1AHTR6HRH3HTR1DCYP2D6
SCHEMBL4655460 0.74
SCHEMBL1559608 0.72 HCAR2 (0.38)
SCHEMBL4654505 0.71
SCHEMBL28249608 0.63 HTR1A (0.37) HTR1AHTR6HRH3HRH4HTR1D
SCHEMBL16320684 0.63 HTR1A (0.37) HTR1AHTR6HRH3HRH4HTR1D
SCHEMBL25247830 0.61 HTR1A (0.53) HTR1AHTR6MPOTSHR
SCHEMBL19953546 0.60
SCHEMBL3161700 0.59 GFER (0.54) HTR1AHRH3CYP2D6TSHRMAOA
SCHEMBL11133065 0.58 KCNH2 (0.52) HTR1AHRH3CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3478687-B1 PYRAZOLOPYRIMIDINE DERIVATIVES AS KINASE INHIBITOR DAEWOONG PHARMACEUTICAL CO LTD (KR) 2024-03-20 EP disclosed
CN-109311896-B Pyrazolopyrimidine derivatives as kinase inhibitors 株式会社大熊制药 2021-08-24 CN disclosed
CN-113135920-A Pyrazolopyrimidine derivatives as kinase inhibitors 株式会社大熊制药 2021-07-20 CN disclosed
US-10961247-B2 Pyrazolopyrimidine derivatives as kinase inhibitor DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2021-03-30 US disclosed
US-20200317673-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS KINASE INHIBITOR DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2020-10-08 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-20200317673-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS KINASE INHIBITOR MAP3K5, MAP3K2, MAPKAPK5 HTR1A 4392/4885HTR6 2819/4885HRH3 2649/4885
US-10961247-B2 Pyrazolopyrimidine derivatives as kinase inhibitor MAP3K5, MAP3K2, MAPKAPK5 HTR1A 4392/4885HTR6 2819/4885HRH3 2649/4885

“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.