SCHEMBL19435264

SCHEMBL19435264

CCNC(CC)CNC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ LMNA P02545 3/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ MMP1 P03956 1/20 0.33
▸ MMP2 P08253 1/20 0.33
▸ MMP8 P22894 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ USP2 O75604 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ ABCC3 O15438 1/20 0.32
▸ SLC6A4 P31645 2/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL17624875 0.83 MTNR1A (0.37) LMNACNR1ADRA1ATDP1CA12
SCHEMBL11709877 0.80 CYP2D6 (0.50) CYP2D6CYP2C19LMNACNR1ADRA1A
SCHEMBL3912737 0.80 CYP2D6 (0.50) CYP2D6CYP2C19LMNACNR1ADRA1A
SCHEMBL24061949 0.74 CYP2D6 (0.48) CYP2D6CYP2C19LMNAMMP1MMP2
SCHEMBL17571386 0.74 SYK (0.52) LMNATDP1CA12CA1CA2
SCHEMBL3274387 0.72 CYP2D6 (0.56) CYP2D6CYP2C19LMNACA2SMN1; SMN2
SCHEMBL18281196 0.72 CYP2D6 (0.56) CYP2D6CYP2C19
SCHEMBL20268376 0.72 CYP2D6 (0.56) CYP2D6CYP2C19LMNACA2SMN1; SMN2
SCHEMBL15987757 0.71 LMNA (0.50) CYP2D6CYP2C19LMNACNR1ADRA1A
SCHEMBL2332543 0.70 — —

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-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2024-07-02 — — US disclosed
EP-3189043-B1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LTD (GB) 2020-11-18 — — EP disclosed
US-20200270247-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR C4X DISCOVERY LIMITED 2020-08-27 — — US disclosed
US-10611760-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor C4X DISCOVERY LIMITED (GB) 2020-04-07 — — US disclosed
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR INDIVIOR INC. 2017-10-12 — — 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-12024509-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor HCRTR1, HCRTR2, NPY1R CYP2D6 2918/4885CYP2C19 2051/4885LMNA 3283/4885
US-20200270247-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR HCRTR1, HCRTR2, NPY1R CYP2D6 2918/4885CYP2C19 2051/4885LMNA 3283/4885
US-10611760-B2 Therapeutic compounds as inhibitors of the orexin-1 receptor HCRTR1, HCRTR2, NPY1R CYP2D6 2918/4885CYP2C19 2051/4885LMNA 3283/4885
US-20170291897-A1 THERAPEUTIC COMPOUNDS AS INHIBITORS OF THE OREXIN-1 RECEPTOR HCRTR1, HCRTR2, NPY1R CYP2D6 2918/4885CYP2C19 2051/4885LMNA 3283/4885

“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.

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