SCHEMBL21526064

SCHEMBL21526064

Cc1nc(C(=O)O)nc(NCCCOC(C)C)c1Cc1ccc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR6 P46095 1/20 0.39
▸ TLR7 Q9NYK1 12/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MDM2 Q00987 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ P2RX7 Q99572 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TP53 P04637 1/20 0.37

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
SCHEMBL21548810 0.93 TLR7 (0.38) TLR7MEN1KMT2ANPSR1
SCHEMBL21526104 0.85 SMN1; SMN2 (0.38) GPR6TLR7HPGDNPSR1P2RX7
SCHEMBL20356749 0.84 SMN1; SMN2 (0.43) TLR7HPGDNPSR1P2RX7HTT
Hydrochloric Acid SCHEMBL21526020 0.83 SMN1; SMN2 (0.42) TLR7HPGDNPSR1P2RX7HTT
SCHEMBL21526073 0.82 SMN1; SMN2 (0.44) MDM2HPGDNPSR1P2RX7HTT
Hydrochloric Acid SCHEMBL21526127 0.81 SMN1; SMN2 (0.43) MDM2HPGDNPSR1P2RX7HTT
SCHEMBL21548809 0.81 SMN1; SMN2 (0.43) MDM2HPGDNPSR1P2RX7HTT
Hydrochloric Acid SCHEMBL21526024 0.81 SMN1; SMN2 (0.43) MDM2HPGDNPSR1P2RX7HTT
SCHEMBL21548806 0.79 SMN1; SMN2 (0.44) KMT2AMDM2HPGDNPSR1P2RX7
SCHEMBL21526096 0.79 KDM4C (0.44) TLR7MEN1KMT2AHPGDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3564216-B1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2021-10-27 — — EP disclosed
EP-3564216-B1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2021-10-27 — — EP disclosed
US-11034659-B2 Pyrimidine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-06-15 — — US disclosed
US-11034659-B2 Pyrimidine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-06-15 — — US disclosed
US-20200172494-A1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-06-04 — — US disclosed
US-20200172494-A1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2020-06-04 — — US disclosed
EP-3564216-A1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-11-06 — — EP disclosed
EP-3564216-A1 PYRIMIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-11-06 — — EP 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-11034659-B2 Pyrimidine derivative GPR39, CFTR, TMEM109 GPR6 16/4885TLR7 1985/4885MEN1 4277/4885
US-20200172494-A1 PYRIMIDINE DERIVATIVE GPR39, CFTR, TMEM109 GPR6 16/4885TLR7 1985/4885MEN1 4277/4885

“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.

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