SCHEMBL24938971

SCHEMBL24938971

CCc1sc2ccccc2c1CN1CCN2C(=O)CN(Cc3ccc(C(F)(F)F)cc3)C(=O)C2C1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 1/20 0.39
▸ LMNA P02545 2/20 0.35
▸ THRB P10828 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ BACE1 P56817 1/20 0.35
▸ HTR1A P08908 1/20 0.34
▸ MCHR1 Q99705 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
SCHEMBL24939892 0.91 LMNA (0.38) NPY1RLMNATHRBHTR1A
SCHEMBL24153475 0.91 KMT2A (0.38) NPY1RLMNATHRBHTR1A
SCHEMBL24939891 0.90 LMNA (0.42) NPY1RLMNATHRBHTR1A
SCHEMBL24938892 0.90 NPY1R (0.41) NPY1RLMNATHRBHTR1A
SCHEMBL24939973 0.89 NPY1R (0.36) NPY1RLMNATHRBHTR1A
SCHEMBL24153613 0.89 NPY1R (0.36) NPY1RLMNATHRBHTR1A
SCHEMBL24153499 0.89 HTR1A (0.39) NPY1RHTR1A
SCHEMBL24939924 0.88 L3MBTL1 (0.41) NPY1R
SCHEMBL23334412 0.87 MAPT (0.35) NPY1RLMNATHRBHTR1A
SCHEMBL24153472 0.86 HTR1A (0.39) NPY1RHTR1A

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 NPY1R 4531/4885LMNA 3175/4885THRB 4791/4885

“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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