SCHEMBL20381220

SCHEMBL20381220

CCN1CCN(C(=O)C2C[C@H]3CC[C@@H]2O3)CC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 6/20 0.54
▸ ACKR3 P25106 6/20 0.43
▸ KCNH2 Q12809 2/20 0.43
▸ KMT2A Q03164 2/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.36
▸ CXCR4 P61073 1/20 0.36
▸ PPP5C P53041 2/20 0.36
▸ PPP2CA P67775 1/20 0.36

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
SCHEMBL15554584 0.83 PPP5C (0.53) ACKR3KCNH2PPP5CPPP2CA
SCHEMBL12390225 0.72 TFPI2 (0.50) HSD11B1KMT2APPP5CPPP2CA
SCHEMBL9880154 0.72 TFPI2 (0.70) HSD11B1PPP5CPPP2CA
SCHEMBL16731305 0.72 TFPI2 (0.70) HSD11B1PPP5CPPP2CA
SCHEMBL14595386 0.71 HSD11B1 (0.58) HSD11B1KMT2AHRH3
SCHEMBL20937145 0.71 HSD11B1 (0.43) HSD11B1ACKR3KCNH2
SCHEMBL7903517 0.70 HSD11B1 (0.82) HSD11B1KMT2A
SCHEMBL14595387 0.69 HSD11B1 (0.63) HSD11B1
SCHEMBL14424154 0.68 MEN1 (0.39) KCNH2KMT2A
SCHEMBL8247132 0.68 MEN1 (0.39) KCNH2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10399993-B2 Oxabicycloheptanes and oxabicycloheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. (US) 2019-09-03 — — US disclosed
US-10023587-B2 Oxabicycloheptanes and oxabicycloheptenes, their preparation and use LIXTE BIOTECHNOLOGY, INC. (US) 2018-07-17 — — 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-10399993-B2 Oxabicycloheptanes and oxabicycloheptenes, their preparation and use HCCS, OXA1L, OTC HSD11B1 56/4885ACKR3 1303/4885KCNH2 3159/4885
US-10023587-B2 Oxabicycloheptanes and oxabicycloheptenes, their preparation and use HCCS, OXA1L, OTC HSD11B1 56/4885ACKR3 1303/4885KCNH2 3159/4885

“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.

Send feedback