SCHEMBL21526009

SCHEMBL21526009

CCCc1nc(CO)nc(OC)c1Cc1ccccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 3/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ CCR4 P51679 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.33
▸ TAAR1 Q96RJ0 1/20 0.33
▸ APLNR P35414 1/20 0.33
▸ BACE1 P56817 1/20 0.32

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
SCHEMBL21526054 0.83 SMN1; SMN2 (0.47) SMN1; SMN2KDM4EALDH1A1HSD17B10CCR4
SCHEMBL21548848 0.81 TLR7 (0.39) TLR7SMN1; SMN2APLNR
SCHEMBL21526106 0.73 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPK1
SCHEMBL21526001 0.71 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL21526068 0.71 PTPN11 (0.36) ALDH1A1CCR4
Hydrochloric Acid SCHEMBL28322143 0.70 SMN1; SMN2 (0.37) SMN1; SMN2
SCHEMBL21526015 0.69 SMN1; SMN2 (0.43) SMN1; SMN2KDM4EALDH1A1HSD17B10CCR4
SCHEMBL21526126 0.69 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1HSD17B10HPGD
SCHEMBL11563713 0.68 APLNR (0.40) KDM4EALDH1A1HSD17B10HPGDMAPK1
SCHEMBL20356757 0.67 ALDH1A1 (0.40) ALDH1A1HSD17B10HPGD

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 TLR7 1985/4885SMN1; SMN2 2983/4885KDM4E 4694/4885
US-20200172494-A1 PYRIMIDINE DERIVATIVE GPR39, CFTR, TMEM109 TLR7 1985/4885SMN1; SMN2 2983/4885KDM4E 4694/4885

“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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