SCHEMBL24364937

SCHEMBL24364937

CNc1cccc(C2=NCCCC2)c1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 12/20 0.64
CHRNA3 P32297 12/20 0.64
CHRNA7 P36544 2/20 0.55
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
THRB P10828 1/20 0.42
CYP2C19 P33261 1/20 0.42
GAA P10253 1/20 0.37
GFER P55789 1/20 0.37
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
BRD4 O60885 1/20 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
SCHEMBL3935574 0.78 CHRNB4 (1.00) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL18985115 0.77 CHRNB4 (0.67) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL24366690 0.75 CHRNB4 (0.66) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL24365656 0.75 BRD4 (0.37) CHRNB4CHRNA3CHRNA7ALDH1A1TSHR
SCHEMBL30989312 0.75 CHRNB4 (1.00) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL895500 0.73 CHRNB4 (1.00) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL6558703 0.73 CHRNB4 (0.90) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL6797483 0.71 CHRNB4 (0.96) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL433117 0.69 CHRNB4 (0.90) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2
SCHEMBL17398232 0.69 CHRNB4 (0.90) CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240279219-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-08-22 US disclosed
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 US disclosed
EP-4188920-A1 PIPERIDIN-1-YL-N-PYRYDINE-3-YL-2-OXOACETAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF MTAP-DEFICIENT AND/OR MTA-ACCUMULATING CANCERS Tango Therapeutics, Inc. (US) 2023-06-07 EP disclosed
US-20230113778-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2023-04-13 US disclosed
US-20220127256-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2022-04-28 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-20240279219-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB4 3299/4885CHRNA3 2163/4885CHRNA7 1575/4885
US-20230113778-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB4 3299/4885CHRNA3 2163/4885CHRNA7 1575/4885
US-20220127256-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB4 3299/4885CHRNA3 2163/4885CHRNA7 1575/4885
US-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 CHRNB4 3299/4885CHRNA3 2163/4885CHRNA7 1575/4885

“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.