SCHEMBL25966746

SCHEMBL25966746

CCn1nc2ncccc2c1C(C)C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 5/20 0.35
▸ KAT2B Q92831 1/20 0.35
▸ MAOB P27338 3/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ TBXAS1 P24557 1/20 0.34
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ MPO P05164 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ MITF O75030 1/20 0.32
▸ IDO1 P14902 2/20 0.32
▸ COMT P21964 1/20 0.32

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
SCHEMBL25966739 0.78 KAT2B (0.35) KAT2BMAOBL3MBTL1KDM4ENPC1
SCHEMBL25966752 0.75 MPO (0.45) KAT2BL3MBTL1MPOKDM4ENPC1
SCHEMBL25966751 0.74 TLR8 (0.35) HTR2CKAT2BMAOBL3MBTL1CYP2C19
SCHEMBL20927208 0.71 L3MBTL1 (0.43) HTR2CL3MBTL1TBXAS1
SCHEMBL25966750 0.68 HASPIN (0.35) HTR2CKAT2BTBXAS1
SCHEMBL25966748 0.68 HASPIN (0.38) HTR2CTBXAS1
SCHEMBL7430492 0.67 ALDH1A1 (0.38) L3MBTL1MPOKDM4ENPC1BRD4
SCHEMBL13562830 0.65 L3MBTL1 (0.67) HTR2CL3MBTL1KDM4ENPC1
SCHEMBL12329417 0.63 L3MBTL1 (0.45) HTR2CL3MBTL1TBXAS1
SCHEMBL30509506 0.63 L3MBTL1 (0.45) HTR2CL3MBTL1TBXAS1

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-20230250060-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 — — US disclosed
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 — — 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 (2 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-20230250060-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 HTR2C 2900/4885KAT2B 3238/4885MAOB 3568/4885
US-20230250088-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 HTR2C 2927/4885KAT2B 3185/4885MAOB 3559/4885

“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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