SCHEMBL24869958

SCHEMBL24869958

O=[N+]([O-])c1cc2c(cc1O)CCNC2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 6/20 0.54
ADRA2A P08913 3/20 0.54
ADCY6 O43306 1/20 0.48
ADCY3 O60266 1/20 0.48
ADCY9 O60503 1/20 0.48
ADCY5 O95622 1/20 0.48
ADCY8 P40145 1/20 0.48
ADCY7 P51828 1/20 0.48
ADCY2 Q08462 1/20 0.48
ADCY1 Q08828 1/20 0.48
ADCY4 Q8NFM4 1/20 0.48
ADRA2B P18089 2/20 0.43
ADRA2C P18825 2/20 0.43
TBXA2R P21731 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
GPR35 Q9HC97 2/20 0.39

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
SCHEMBL28069542 1.00 PNMT (0.54) PNMTADRA2AADCY6ADCY3ADCY9
SCHEMBL28027769 0.88 GPR35 (0.44) PNMTADRA2ATBXA2RALDH1A1MAPT
SCHEMBL8258918 0.82 PNMT (0.55) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL29557821 0.81 MAPT (0.60) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL18875031 0.81 PNMT (0.54) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL31335752 0.81 MAPT (0.60) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL24040085 0.81 PNMT (0.54) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL417912 0.81 MAPT (0.60) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL13875069 0.81 PNMT (0.54) PNMTADRA2AADRA2BADRA2CHTR2A
SCHEMBL18875034 0.81 PNMT (0.54) PNMTADRA2AADRA2BADRA2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720038-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2026-04-08 EP disclosed
US-12577267-B2 Pyrimidine compounds for use as MAP4K1 inhibitors GLENMARK SPECIALITY S.A. (CH) 2026-03-17 US disclosed
WO-2024246496-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2024-12-05 WO disclosed
EP-4367123-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS Glenmark Specialty S.A. (CH) 2024-05-15 EP disclosed
CN-117730083-A Pyrimidine compounds as MAP4K1 inhibitors 格兰马克专业公司 2024-03-19 CN disclosed
US-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALITY S.A. (CH) 2023-07-20 US disclosed
US-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALITY S.A. (CH) 2023-07-20 US disclosed
US-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALITY S.A. (CH) 2023-07-20 US disclosed
WO-2023281417-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALTY S.A. (CH) 2023-01-12 WO disclosed
WO-2023281417-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALTY S.A. (CH) 2023-01-12 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 (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-12577267-B2 Pyrimidine compounds for use as MAP4K1 inhibitors PTK2B, MAP3K10, MAP3K20 PNMT 2048/4885ADRA2A 2954/4885ADCY6 2254/4885
US-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS MAP4K1, MAP3K4, MAP4K2 PNMT 2911/4885ADRA2A 4209/4885ADCY6 3145/4885

“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.