SCHEMBL24939864

SCHEMBL24939864

O=C1NCC(=O)N2CCN(Cc3csc4ccccc34)CC12

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.49
▸ CRHBP P24387 1/20 0.48
▸ CRHR2 Q13324 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ FAAH O00519 1/20 0.44
▸ DRD2 P14416 5/20 0.43
▸ DRD4 P21917 5/20 0.43
▸ DRD3 P35462 5/20 0.43
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ PDE2A O00408 1/20 0.38
▸ CYP2A6 P11509 2/20 0.36
▸ CMA1 P23946 1/20 0.36
▸ OPRM1 P35372 2/20 0.35
▸ OPRK1 P41145 2/20 0.35

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
SCHEMBL23334390 0.81 UTS2R (0.40) CHRNA7CRHBPCRHR2SMN1; SMN2FAAH
SCHEMBL30337109 0.81 TSHR (0.47) FAAHDRD2DRD4DRD3OPRM1
SCHEMBL24939952 0.81 CHRNA7 (0.47) CHRNA7CRHBPCRHR2SMN1; SMN2FAAH
SCHEMBL24939934 0.79 CYP2D6 (0.56) SMN1; SMN2DRD2DRD4DRD3
SCHEMBL24938970 0.79 CYP1A2 (0.38) SMN1; SMN2
SCHEMBL24152329 0.78 GSK3B (0.50) SMN1; SMN2DRD2
SCHEMBL24938955 0.77 LMNA (0.49) SMN1; SMN2DRD2DRD4DRD3HDAC8
SCHEMBL23303909 0.77 NPY1R (0.35) —
SCHEMBL23302562 0.77 NPY1R (0.35) —
SCHEMBL29695401 0.77 NPY1R (0.35) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230019094-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME HOLOSMEDIC (KR) 2023-01-19 — — 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 (1 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-20230019094-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, ABCC1 CHRNA7 4780/4885CRHBP 4561/4885CRHR2 4352/4885

“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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