SCHEMBL18934262

SCHEMBL18934262

CN1CCC(CN2CCN(CCN3CCCCC3)CC2)C1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.52
ADRA2C P18825 1/20 0.52
ACHE P22303 1/20 0.41
CYP1A2 P05177 2/20 0.39
NCF1 P14598 1/20 0.38
CYP2D6 P10635 1/20 0.37
HRH3 Q9Y5N1 3/20 0.37
MAPT P10636 1/20 0.35
CCR2 P41597 1/20 0.35
KCNH2 Q12809 1/20 0.35
CACNA2D1 P54289 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNB1 Q02641 1/20 0.35
CACNA1C Q13936 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
HTR7 P34969 1/20 0.34
HRH1 P35367 1/20 0.34

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
SCHEMBL14469252 0.94 CHRM5 (0.58) CHRM5ADRA2CACHECYP1A2NCF1
SCHEMBL13874583 0.92 CHRM5 (0.54) CHRM5ADRA2CACHECYP1A2NCF1
SCHEMBL3440544 0.92 CHRM5 (0.54) CHRM5ADRA2CACHECYP1A2NCF1
SCHEMBL8318507 0.92 CHRM5 (0.54) CHRM5ADRA2CACHECYP1A2NCF1
SCHEMBL19155633 0.90 CHRM5 (0.59) CHRM5ADRA2CACHECYP1A2NCF1
SCHEMBL20927276 0.88 CHRM5 (0.48) CHRM5ADRA2CACHECYP1A2NCF1
SCHEMBL21094075 0.87 CHRM5 (0.45) CHRM5ADRA2CACHECYP1A2NCF1
SCHEMBL10070997 0.84 CHRM5 (0.61) CHRM5ADRA2CACHECYP1A2CYP2D6
SCHEMBL18898074 0.84 CHRM5 (0.68) CHRM5ADRA2CACHECYP1A2HRH3
SCHEMBL22953689 0.84 CHRM5 (0.61) CHRM5ADRA2CACHECYP1A2CYP2D6

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
US-10633357-B2 Intermediates and process for preparing intermediates in the production of substituted pyrazolopyridines ADVERIO PHARMA GMBH (DE) 2020-04-28 US disclosed
US-10364229-B2 Crystalline substituted 5-fluoro-1H-pyrazolopyridines and process for preparing ADVERIO PHARMA GMBH (DE) 2019-07-30 US disclosed
US-20180065942-A1 CRYSTALLINE SUBSTITUTED 5-FLUORO-1H-PYRAZOLOPYRIDINES AND PROCESS FOR PREPARING ADVERIO PHARMA GMBH (DE) 2018-03-08 US disclosed
US-9845300-B2 Process for preparing substituted 5-fluoro-1H-pyrazolopyridines ADVERIO PHARMA GMBH (DE) 2017-12-19 US disclosed
US-20170158652-A1 PROCESS FOR PREPARING SUBSTITUTED 5-FLUORO-1H-PYRAZOLOPYRIDINES ADVERIO PHARMA GMBH (DE) 2017-06-08 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 (4 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-20170158652-A1 PROCESS FOR PREPARING SUBSTITUTED 5-FLUORO-1H-PYRAZOLOPYRIDINES CYP3A5, CYP4F2, CYP2F1 CHRM5 488/4885ADRA2C 154/4885ACHE 1265/4885
US-10364229-B2 Crystalline substituted 5-fluoro-1H-pyrazolopyridines and process for preparing CYP3A5, CYP2F1, CYP4F2 CHRM5 217/4885ADRA2C 120/4885ACHE 1271/4885
US-20180065942-A1 CRYSTALLINE SUBSTITUTED 5-FLUORO-1H-PYRAZOLOPYRIDINES AND PROCESS FOR PREPARING CYP3A5, CYP2F1, CYP4F2 CHRM5 217/4885ADRA2C 120/4885ACHE 1271/4885
US-10633357-B2 Intermediates and process for preparing intermediates in the production of substituted pyrazolopyridines CYP3A5, CYP4F2, CYP2F1 CHRM5 804/4885ADRA2C 392/4885ACHE 1167/4885

“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.