SCHEMBL21494712

SCHEMBL21494712

O=C(O)c1ccc([N+](=O)[O-])c(Oc2ccccc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 4/20 0.55
MERTK Q12866 1/20 0.48
MYC P01106 1/20 0.47
MAX P61244 1/20 0.47
MCL1 Q07820 1/20 0.46
APP P05067 1/20 0.46
KMT2A Q03164 7/20 0.46
MEN1 O00255 6/20 0.46
THRB P10828 2/20 0.46
TTR P02766 1/20 0.46
ALB P02768 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ATM Q13315 1/20 0.44
HPSE Q9Y251 1/20 0.43
ALDH1A1 P00352 2/20 0.41
MITF O75030 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL12374079 0.82 PIN1 (0.57) PIN1MERTKKMT2AMEN1THRB
SCHEMBL30068176 0.80 MYC (0.53) MERTKMYCMAXAPPTDP1
SCHEMBL4651273 0.80 MYC (0.53) MERTKMYCMAXAPPTDP1
SCHEMBL4652574 0.79 APP (0.67) PIN1MYCMAXMCL1APP
SCHEMBL12374077 0.79 PIN1 (0.57) PIN1MERTKKMT2AMEN1THRB
SCHEMBL21515183 0.78 KMT2A (0.47) PIN1MERTKMYCMAXAPP
SCHEMBL4652365 0.77 MYC (0.56) MYCMAXMCL1APPTDP1
SCHEMBL31326400 0.77 MYC (0.50) MERTKMYCMAXAPPTDP1
SCHEMBL23005125 0.76 FPR2 (0.53) PIN1MYCMAXAPP
SCHEMBL23005126 0.76 FPR2 (0.53) PIN1MYCMAXAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12357634-B2 2,6-diamino-3,4-dihydropyrimidin-4-one derivatives and use thereof in therapy THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2025-07-15 US disclosed
CN-112218858-B 2, 6-Diamino-3, 4-dihydropyrimidin-4-one derivatives and their use in therapy 托马斯·黑勒戴药物研究基金会 2024-06-18 CN disclosed
EP-3781554-B1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY THOMAS HELLEDAYS STIFTELSE FOER MEDICINSK FORSKNING (SE) 2023-06-28 EP disclosed
US-20230110478-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2023-04-13 US disclosed
US-11504368-B2 2,6-diamino-3,4-dihydropyrimidin-4-one derivatives and use thereof in therapy THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2022-11-22 US disclosed
US-20210052587-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY MEDICINSK FORSKNING (SE) 2021-02-25 US disclosed
EP-3781554-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY Thomas Helledays stiftelse för medicinsk forskning (SE) 2021-02-24 EP disclosed
CN-112218858-A 2, 6-diamino-3, 4-dihydropyrimidin-4-one derivatives and their use in therapy 托马斯·黑勒戴药物研究基金会 2021-01-12 CN disclosed
WO-2019201991-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) 2019-10-24 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 (4 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-11504368-B2 2,6-diamino-3,4-dihydropyrimidin-4-one derivatives and use thereof in therapy IL2, THPO, IL6 PIN1 980/4885MERTK 1464/4885MYC 2431/4885
US-20230110478-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY IL2, THPO, IL6 PIN1 927/4885MERTK 1400/4885MYC 2305/4885
US-12357634-B2 2,6-diamino-3,4-dihydropyrimidin-4-one derivatives and use thereof in therapy IL2, THPO, IL6 PIN1 927/4885MERTK 1400/4885MYC 2305/4885
US-20210052587-A1 2,6-DIAMINO-3,4-DIHYDROPYRIMIDIN-4-ONE DERIVATIVES AND USE THEREOF IN THERAPY IL2, THPO, IL6 PIN1 980/4885MERTK 1464/4885MYC 2431/4885

“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.