SCHEMBL20552124

SCHEMBL20552124

COc1cccc(Nc2cc(-c3ccccc3)nc(C3CCN(C(=O)OC(C)(C)C)CC3)n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
TP53 P04637 1/20 0.52
HTT P42858 2/20 0.51
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
HPGD P15428 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TSHR P16473 1/20 0.48
CRHBP P24387 1/20 0.48
CRHR2 Q13324 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TGFBR1 P36897 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
ABCB1 P08183 2/20 0.45
ABCG2 Q9UNQ0 2/20 0.45
ACP1 P24666 1/20 0.43
MKNK1 Q9BUB5 1/20 0.43
ABCC1 P33527 1/20 0.43
JAK2 O60674 1/20 0.43

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
SCHEMBL20551540 0.91 TP53 (0.50) MAPTTP53HTTALDH1A1TSHR
SCHEMBL21750810 0.91 TP53 (0.50) MAPTTP53HTTALDH1A1TSHR
SCHEMBL28359727 0.88 TP53 (0.48) MAPTTP53HTTALDH1A1KDM4E
SCHEMBL20551736 0.87 JAK2 (0.52) TP53HTTALDH1A1KDM4EHPGD
SCHEMBL29887170 0.85 TP53 (0.51) MAPTTP53ABCB1ABCG2MKNK1
SCHEMBL31379875 0.82 IGF1R (0.42) MAPTHTTALDH1A1KDM4EHPGD
SCHEMBL31379897 0.82 JAK2 (0.42) MAPTHTTALDH1A1KDM4EHPGD
SCHEMBL21750686 0.82 HTT (0.49) MAPTHTTALDH1A1KDM4EHPGD
SCHEMBL20551893 0.82 HTT (0.49) MAPTHTTALDH1A1KDM4EHPGD
SCHEMBL20552141 0.81 TP53 (0.50) MAPTTP53ABCB1ABCG2MKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503456-B2 Substituted pyrimidines and 1,3,5-triazines as RHOJ inhibitors FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2025-12-23 US disclosed
EP-3825310-B1 TRISUBSTITUTED PYRIMIDINE COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER, RETINAL DISORDERS, AND CARDIOMYOPATHIES FONDAZIONE ST ITALIANO TECNOLOGIA (IT) 2025-11-12 EP disclosed
US-20240391898-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2024-11-28 US disclosed
US-11952366-B2 Substituted 1,3,5-triazines as inhibitors for a rho family of GTP-ases FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2024-04-09 US disclosed
US-20220242848-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2022-08-04 US disclosed
US-11198682-B2 Substituted pyrimidines as inhibitors for a Rho family of GTP-ases FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2021-12-14 US disclosed
US-11198682-B2 Substituted pyrimidines as inhibitors for a Rho family of GTP-ases FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2021-12-14 US disclosed
EP-3619202-B1 TRISUBSTITUTED PYRIMIDINE COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER, RETINAL DISORDERS, AND CARDIOMYOPATHIES FONDAZIONE ST ITALIANO TECNOLOGIA (IT) 2021-06-30 EP disclosed
EP-3619202-B1 TRISUBSTITUTED PYRIMIDINE COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER, RETINAL DISORDERS, AND CARDIOMYOPATHIES FONDAZIONE ST ITALIANO TECNOLOGIA (IT) 2021-06-30 EP disclosed
EP-3825310-A1 TRISUBSTITUTED PYRIMIDINE COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER, RETINAL DISORDERS, AND CARDIOMYOPATHIES Fondazione Istituto Italiano di Tecnologia (IT) 2021-05-26 EP disclosed
EP-3825310-A1 TRISUBSTITUTED PYRIMIDINE COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER, RETINAL DISORDERS, AND CARDIOMYOPATHIES Fondazione Istituto Italiano di Tecnologia (IT) 2021-05-26 EP disclosed
EP-3619202-A1 TRISUBSTITUTED PYRIMIDINE COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER, RETINAL DISORDERS, AND CARDIOMYOPATHIES Fondazione Istituto Italiano di Tecnologia (IT) 2020-03-11 EP disclosed
US-20200062733-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2020-02-27 US disclosed
US-20200062733-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2020-02-27 US disclosed
WO-2018203256-A1 TRISUBSTITUTED PYRIMIDINE COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER, RETINAL DISORDERS, AND CARDIOMYOPATHIES FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2018-11-08 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 (6 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-11952366-B2 Substituted 1,3,5-triazines as inhibitors for a rho family of GTP-ases CDC42, RHOA, TNK2 MAPT 1329/4885TP53 2062/4885HTT 2889/4885
US-12503456-B2 Substituted pyrimidines and 1,3,5-triazines as RHOJ inhibitors TNK2, CDC42, CDC42BPA MAPT 878/4885TP53 1329/4885HTT 3789/4885
US-20200062733-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies CDC42, RHOA, RHOT2 MAPT 1372/4885TP53 1479/4885HTT 3502/4885
US-20240391898-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies CDC42, RHOA, RHOT2 MAPT 1372/4885TP53 1479/4885HTT 3502/4885
US-11198682-B2 Substituted pyrimidines as inhibitors for a Rho family of GTP-ases CDC42, TNK2, ARHGEF1 MAPT 1109/4885TP53 942/4885HTT 3174/4885
US-20220242848-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies CDC42, RHOA, RHOT2 MAPT 1372/4885TP53 1479/4885HTT 3502/4885

“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.