SCHEMBL25975796

SCHEMBL25975796

NCc1ccc(-c2nc(C(F)(F)F)cn2C2CCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP1 O94782 12/20 0.41
MAP3K12 Q12852 1/20 0.35
PTGS2 P35354 4/20 0.34
PTGS1 P23219 3/20 0.34
MPO P05164 1/20 0.34
KCNH2 Q12809 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.33
NPBWR1 P48145 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
SCHEMBL18865679 0.95 USP1 (0.44) USP1PTGS2PTGS1MPOKCNH2
SCHEMBL18865985 0.95 USP1 (0.44) USP1PTGS2PTGS1MPOKCNH2
SCHEMBL31625222 0.89 USP1 (0.39) USP1PTGS2PTGS1MPOKCNH2
SCHEMBL31155892 0.87 USP1 (0.41) USP1MAP3K12PTGS2
SCHEMBL18865878 0.86 USP1 (0.47) USP1PTGS2PTGS1MPOKCNH2
SCHEMBL31625007 0.84 USP1 (0.41) USP1
SCHEMBL27174302 0.82 USP1 (0.44) USP1PTGS2PTGS1
SCHEMBL26627857 0.82 USP1 (0.48) USP1PTGS2PTGS1
SCHEMBL30966308 0.82 USP1 (0.44) USP1PTGS2PTGS1
SCHEMBL27097116 0.81 USP1 (0.37) USP1

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
WO-2025129135-A2 COMPOSITIONS COMPRISING USP1 INHIBITORS AND METHODS OF USING THE SAME EIKON THERAPEUTICS, INC. (US) 2025-06-19 WO disclosed
US-20240059689-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS MEDIVIR AB (SE) 2024-02-22 US disclosed
EP-4308566-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS Tango Therapeutics, Inc. (US) 2024-01-24 EP disclosed
CN-117425656-A Purine derivatives as anticancer agents 探戈医药股份有限公司 2024-01-19 CN disclosed
WO-2023148643-A1 FUSED BICYCLIC HETEROCYCLYL COMPOUNDS AS USP1 INHIBITORS AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 WO disclosed
WO-2022197892-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS TANGO THERAPEUTICS, INC. (US) 2022-09-22 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-20240059689-A1 PURINE DERIVATIVES AS ANTICANCER AGENTS RRM2, TYMP, PNP USP1 1532/4885MAP3K12 2639/4885PTGS2 2912/4885

“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.