SCHEMBL23303909

SCHEMBL23303909

CCc1sc2ccccc2c1CN1CCN2C(=O)CNC(=O)C2C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 14/20 0.35
▸ PARP1 P09874 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ CNR1 P21554 1/20 0.30
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL23302562 1.00 NPY1R (0.35) NPY1RPARP1ALDH1A1CNR1CNR2
SCHEMBL29695401 1.00 NPY1R (0.35) NPY1RPARP1ALDH1A1CNR1CNR2
SCHEMBL24938894 0.91 NPY1R (0.35) NPY1RPARP1CNR1CNR2
SCHEMBL24939951 0.89 CNR2 (0.35) NPY1RPARP1CNR1CNR2
SCHEMBL24939890 0.88 GSK3A (0.34) NPY1RPARP1ALDH1A1
SCHEMBL24938970 0.88 CYP1A2 (0.38) NPY1RPARP1ALDH1A1
SCHEMBL24939893 0.87 SMN1; SMN2 (0.36) NPY1RPARP1
SCHEMBL24939989 0.86 NPY1R (0.36) NPY1R
SCHEMBL24938953 0.85 NPY1R (0.41) NPY1R
SCHEMBL24939986 0.85 CYP2D6 (0.42) NPY1R

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-20230019094-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME HOLOSMEDIC (KR) 2023-01-19 — — US disclosed
US-20230019094-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME HOLOSMEDIC (KR) 2023-01-19 — — US disclosed
EP-4053127-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME Holosmedic (KR) 2022-09-07 — — EP disclosed
WO-2021261969-A1 PREPARATION METHOD FOR NOVEL COMPOUND 홀로스메딕 주식회사 2021-12-30 — — WO disclosed
WO-2021086038-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME 홀로스메딕 주식회사 2021-05-06 — — WO 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 NPY1R 4531/4885PARP1 1338/4885ALDH1A1 2653/4885

“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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