SCHEMBL25975182

SCHEMBL25975182

N#Cc1ccc(-c2nc(C(F)(F)F)cn2C2CCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.40
CYP11B1 P15538 2/20 0.40
KDM1A O60341 2/20 0.39
KIF11 P52732 2/20 0.39
KDM2B Q8NHM5 1/20 0.36
PDPK1 O15530 1/20 0.35
USP1 O94782 1/20 0.35
HSD11B1 P28845 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
UBE2N P61088 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PTGS2 P35354 1/20 0.34
SYK P43405 1/20 0.34
SDHB P21912 1/20 0.33
MAOB P27338 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
SCHEMBL18865485 0.95 CYP11B2 (0.44) CYP11B2CYP11B1KDM1AKIF11PDPK1
SCHEMBL31254896 0.89 TGFBR1 (0.41) CYP11B2CYP11B1KDM1AKIF11PDPK1
SCHEMBL18886504 0.86 KDM1A (0.42) CYP11B2CYP11B1KDM1AKIF11PDPK1
SCHEMBL29864349 0.86 USP1 (0.41) CYP11B2CYP11B1KDM1AKIF11PDPK1
Hydrochloric Acid SCHEMBL18865617 0.85 KDM1A (0.42) CYP11B2CYP11B1KDM1AKIF11PDPK1
SCHEMBL29864259 0.85 USP1 (0.41) CYP11B2CYP11B1KDM1AKIF11USP1
SCHEMBL31254602 0.81 KIF11 (0.38) CYP11B2CYP11B1KDM1AKIF11PDPK1
SCHEMBL18865631 0.80 TGFBR1 (0.37) CYP11B2CYP11B1KDM1AALDH1A1PTGS2
SCHEMBL31155892 0.80 USP1 (0.41) KIF11USP1PTGS2
SCHEMBL25975796 0.80 USP1 (0.41) USP1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CYP11B2 1801/4885CYP11B1 1208/4885KDM1A 2575/4885

“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.