SCHEMBL23334412

SCHEMBL23334412

CCc1sc2ccccc2c1CN1CCN2C(=O)CN(Cc3ccc(C#N)cc3)C(=O)C2C1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.35
▸ NPY1R P25929 2/20 0.34
▸ HTR1A P08908 1/20 0.34
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ PRMT5 O14744 4/20 0.33
▸ WDR77 Q9BQA1 4/20 0.33
▸ FAAH O00519 1/20 0.33

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
SCHEMBL24153475 0.91 KMT2A (0.38) MAPTNPY1RHTR1ATHRBLMNA
SCHEMBL24938892 0.90 NPY1R (0.41) NPY1RHTR1ATHRBLMNA
SCHEMBL24939891 0.90 LMNA (0.42) MAPTNPY1RHTR1ATHRBLMNA
SCHEMBL24939892 0.89 LMNA (0.38) MAPTNPY1RHTR1ATHRBLMNA
SCHEMBL24153613 0.89 NPY1R (0.36) MAPTNPY1RHTR1ATHRBLMNA
SCHEMBL24939973 0.89 NPY1R (0.36) MAPTNPY1RHTR1ATHRBLMNA
SCHEMBL24153499 0.89 HTR1A (0.39) NPY1RHTR1A
SCHEMBL24153472 0.88 HTR1A (0.39) NPY1RHTR1A
SCHEMBL24939924 0.88 L3MBTL1 (0.41) MAPTNPY1R
SCHEMBL24938971 0.87 NPY1R (0.39) NPY1RHTR1ATHRBLMNA

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-20230019094-A1 NOVEL COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTION OR TREATMENT OF CANCER COMPRISING SAME HOLOSMEDIC (KR) 2023-01-19 — — US 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 MAPT 4096/4885NPY1R 4531/4885HTR1A 4854/4885

“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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