SCHEMBL20356665

SCHEMBL20356665

Cc1nc(C(=O)O)nc(CCc2cccnc2)c1Cc1ccccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TP53 P04637 3/20 0.39
▸ LMNA P02545 3/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ MAPT P10636 3/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ NAMPT P43490 3/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RECQL P46063 1/20 0.37
▸ TBXAS1 P24557 1/20 0.37
▸ P2RX3 P56373 1/20 0.37
▸ BRS3 P32247 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
SCHEMBL21526006 0.89 SMN1; SMN2 (0.43) SMN1; SMN2TP53LMNATDP1MAPT
SCHEMBL21548831 0.82 SMN1; SMN2 (0.41) SMN1; SMN2TP53LMNATDP1POLB
SCHEMBL21526023 0.82 SMN1; SMN2 (0.51) SMN1; SMN2TP53LMNATDP1MAPT
SCHEMBL21526079 0.82 GPR132 (0.44) SMN1; SMN2TP53LMNATDP1POLB
SCHEMBL21526092 0.80 SMN1; SMN2 (0.56) SMN1; SMN2TP53LMNATDP1MAPT
SCHEMBL21526045 0.76 SMN1; SMN2 (0.52) SMN1; SMN2TP53LMNATDP1MAPT
SCHEMBL21548842 0.76 SMN1; SMN2 (0.39) SMN1; SMN2TP53LMNATDP1POLB
SCHEMBL20356576 0.73 SMN1; SMN2 (0.44) SMN1; SMN2TP53LMNATDP1MAPT
SCHEMBL21526132 0.73 SMN1; SMN2 (0.49) SMN1; SMN2TP53LMNATDP1MAPT
SCHEMBL20356703 0.72 SMN1; SMN2 (0.48) SMN1; SMN2TP53LMNATDP1MAPT

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 7 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-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
WO-2018124000-A1 PYRIMIDINE DERIVATIVE 第一三共株式会社 2018-07-05 — — 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 (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 SMN1; SMN2 2983/4885TP53 2921/4885LMNA 3852/4885
US-20200172494-A1 PYRIMIDINE DERIVATIVE GPR39, CFTR, TMEM109 SMN1; SMN2 2983/4885TP53 2921/4885LMNA 3852/4885

“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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