SCHEMBL19640010

SCHEMBL19640010

CN1CCC(NC(=O)C2CCC(N)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
TSHR P16473 1/20 0.45
SMYD3 Q9H7B4 1/20 0.43
CYP2D6 P10635 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
GAA P10253 2/20 0.42
CYP3A4 P08684 2/20 0.41
RAB9A P51151 1/20 0.41
EPHX2 P34913 3/20 0.40
MAPK1 P28482 2/20 0.40
KDM5A P29375 1/20 0.40
ALDH1A1 P00352 5/20 0.40
LMNA P02545 2/20 0.40
PKM P14618 1/20 0.39
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL19522186 1.00 POLB (0.46) POLBL3MBTL1TSHRSMYD3CYP2D6
SCHEMBL10265288 0.91 POLB (0.53) POLBL3MBTL1TSHRCYP2D6HRH3
SCHEMBL20159607 0.87 L3MBTL1 (0.51) POLBL3MBTL1TSHRCYP2D6HRH3
SCHEMBL19640008 0.86 POLB (0.46) POLBL3MBTL1TSHRCYP2D6HRH3
SCHEMBL19684406 0.86 SMYD3 (0.43) POLBL3MBTL1TSHRSMYD3CYP2D6
SCHEMBL17625632 0.84 L3MBTL1 (0.57) POLBL3MBTL1TSHRCYP2D6HRH3
SCHEMBL13783325 0.84 L3MBTL1 (0.61) L3MBTL1TSHRCYP2D6HRH3GAA
SCHEMBL13783322 0.83 MAPK1 (0.53) POLBL3MBTL1TSHRGAACYP3A4
SCHEMBL3210529 0.83 POLB (0.57) POLBL3MBTL1SMYD3EPHX2MAPK1
SCHEMBL3399349 0.83 POLB (0.57) POLBL3MBTL1SMYD3EPHX2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464268-B1 NOVEL COMPOUNDS CHIESI FARM SPA (IT) 2020-03-11 EP claimed
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties CHIESI FARMACEUTICI S.P.A. (IT) 2019-01-08 US claimed
US-20170340611-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US claimed
EP-3464268-B1 NOVEL COMPOUNDS CHIESI FARM SPA (IT) 2020-03-11 EP disclosed
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties CHIESI FARMACEUTICI S.P.A. (IT) 2019-01-08 US disclosed
US-20170340611-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 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-20170340611-A1 NOVEL COMPOUNDS SERPINB1, ELANE, MPO POLB 1592/4885L3MBTL1 3334/4885TSHR 4582/4885
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties SERPINB1, ELANE, EPX POLB 1721/4885L3MBTL1 3684/4885TSHR 4300/4885

“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.