SCHEMBL21750806

SCHEMBL21750806

CN(C)c1cccc(Nc2cc(-c3ccccc3)nc(C3CCCN(C(=O)OC(C)(C)C)C3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 9/20 0.46
JAK2 O60674 1/20 0.45
JAK3 P52333 1/20 0.45
PTK2 Q05397 1/20 0.45
HPGDS O60760 2/20 0.44
ACKR3 P25106 1/20 0.41
PRMT5 O14744 2/20 0.40
APLNR P35414 1/20 0.39
MAPK8 P45983 1/20 0.39
MAPK10 P53779 1/20 0.39
MAPK14 Q16539 1/20 0.39
ACP1 P24666 1/20 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
SCHEMBL21750727 0.92 USP30 (0.45) USP30JAK2JAK3PTK2HPGDS
SCHEMBL20551736 0.91 JAK2 (0.52) USP30JAK2JAK3PTK2HPGDS
SCHEMBL20551540 0.88 TP53 (0.50) USP30HPGDSACKR3PRMT5APLNR
SCHEMBL21750810 0.88 TP53 (0.50) USP30HPGDSACKR3PRMT5APLNR
SCHEMBL20551893 0.84 HTT (0.49) USP30HPGDSACKR3PRMT5APLNR
SCHEMBL21750686 0.84 HTT (0.49) USP30HPGDSACKR3PRMT5APLNR
SCHEMBL21750805 0.80 GRM1 (0.46) JAK2JAK3PTK2
SCHEMBL31379880 0.79 JAK2 (0.56) USP30JAK2JAK3PTK2HPGDS
SCHEMBL20552488 0.79 ACP1 (0.40) JAK2JAK3PTK2ACP1
SCHEMBL31310816 0.79 ACP1 (0.40) JAK2JAK3PTK2ACP1

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 12 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-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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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 USP30 4340/4885JAK2 2831/4885JAK3 2979/4885
US-12503456-B2 Substituted pyrimidines and 1,3,5-triazines as RHOJ inhibitors TNK2, CDC42, CDC42BPA USP30 4671/4885JAK2 1213/4885JAK3 1183/4885
US-20200062733-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies CDC42, RHOA, RHOT2 USP30 4684/4885JAK2 4468/4885JAK3 4374/4885
US-11198682-B2 Substituted pyrimidines as inhibitors for a Rho family of GTP-ases CDC42, TNK2, ARHGEF1 USP30 4640/4885JAK2 2881/4885JAK3 2979/4885
US-20220242848-A1 Compounds and Compositions for the Treatment of Cancer, Retinal Disorders, and Cardiomyopathies CDC42, RHOA, RHOT2 USP30 4684/4885JAK2 4468/4885JAK3 4374/4885

“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.