SCHEMBL2773343

SCHEMBL2773343

CN1CCC(N)(c2ccc(F)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
DUSP3 P51452 1/20 0.44
PTPN5 P54829 1/20 0.44
PTPN11 Q06124 1/20 0.44
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
DRD2 P14416 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
RAB9A P51151 1/20 0.40
TACR1 P25103 2/20 0.40
SLC6A4 P31645 2/20 0.40
KCNH2 Q12809 2/20 0.40
DRD4 P21917 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAOA P21397 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
SCHEMBL56590 0.81 MAOB (0.48) SLC6A3MAOAMAOB
SCHEMBL6888881 0.80 HSD11B1 (0.50) OPRM1SLC6A3DRD2LMNAALDH1A1
SCHEMBL56772 0.80 OPRM1 (0.60) OPRM1SLC6A4KCNH2DRD4
SCHEMBL23112661 0.80 MAOB (0.41) OPRM1SLC6A3KMT2AMAOAMAOB
Hydrochloric Acid SCHEMBL1918396 0.79 MAOB (0.46) SLC6A3MAOAMAOB
SCHEMBL3030734 0.79 OPRM1 (0.39) OPRM1SLC6A3KMT2ADRD4
SCHEMBL15715779 0.78 OPRM1 (0.48) OPRM1SMN1; SMN2DUSP3PTPN5PTPN11
SCHEMBL6926354 0.78 OPRM1 (0.51) OPRM1SMN1; SMN2DUSP3PTPN5PTPN11
SCHEMBL20491450 0.78 RORC (0.44) ALDH1A1
SCHEMBL8254657 0.77 SLC6A3 (0.48) SLC6A3MAOAMAOB

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
US-20220324865-A1 SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-10-13 US disclosed
EP-3793559-A1 SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES Bayer Aktiengesellschaft (DE) 2021-03-24 EP disclosed
CN-112469412-A Substituted dihydropyrazolopyrazine carboxamide derivatives 拜耳公司 2021-03-09 CN disclosed
EP-1753739-B1 IMIDAZOL-2-ONE COMPOUNDS USEFUL IN THE TREATMENT OF VARIOUS DISORDERS GLAXO GROUP LTD (GB) 2010-04-28 EP disclosed
US-7534893-B2 Imidazol-2-one compounds useful in the treatment of various disorders GLAXO GROUP LIMITED (GB) 2009-05-19 US disclosed
US-20070249679-A1 Imidazol-2-One Compounds Useful in the Treatment of Various Disorders GLAXO GROUP LIMITED (GB) 2007-10-25 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-20220324865-A1 SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES QDPR, SIRT5, PDXK OPRM1 3834/4885SMN1; SMN2 3131/4885DUSP3 816/4885
US-20070249679-A1 Imidazol-2-One Compounds Useful in the Treatment of Various Disorders SLC6A4, SLC18A2, SLC18A1 OPRM1 167/4885SMN1; SMN2 1787/4885DUSP3 3519/4885

“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.