SCHEMBL25321981

SCHEMBL25321981

COc1ncc(C2=NCC(C)CC2)cc1C

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ NOS3 P29474 1/20 0.33
▸ NOS1 P29475 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ TTK P33981 1/20 0.33
▸ AURKB Q96GD4 1/20 0.33
▸ INCENP Q9NQS7 1/20 0.33
▸ PIK3CD O00329 7/20 0.32
▸ PIK3R1 P27986 1/20 0.31
▸ PIK3CA P42336 3/20 0.31
▸ ESR1 P03372 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
SCHEMBL25321976 1.00 MAPT (0.33) MAPTCASP1MTORNOS3NOS1
SCHEMBL25322871 0.82 CYP2A6 (0.37) NOS3NOS1NOS2
SCHEMBL25322868 0.82 CYP2A6 (0.37) NOS3NOS1NOS2
SCHEMBL30551056 0.81 NOS3 (0.33) MAPTNOS3NOS1NOS2
SCHEMBL25322318 0.81 NOS3 (0.33) MAPTNOS3NOS1NOS2
SCHEMBL25322320 0.81 NOS3 (0.33) MAPTNOS3NOS1NOS2
SCHEMBL24365547 0.76 NOS3 (0.41) NOS3NOS1NOS2
SCHEMBL25324054 0.74 CYP1A1 (0.41) —
SCHEMBL24233854 0.74 CYP2A6 (0.41) —
SCHEMBL25324052 0.74 CYP1A1 (0.41) —

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-20250163048-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2025-05-22 — — US disclosed
WO-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — 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-20250163048-A1 COMPOUNDS AND METHODS OF USE RB1, CYP1B1, REN MAPT 2959/4885CASP1 1749/4885MTOR 1587/4885

“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.

Send feedback