SCHEMBL20356707

SCHEMBL20356707

Cc1nc(C(=O)O)nc(OCc2ccc(F)cc2)c1Cc1ccccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ HPGD P15428 1/20 0.40
▸ RXRA P19793 1/20 0.40
▸ RXRB P28702 1/20 0.40
▸ PTGER1 P34995 3/20 0.40
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PLA2G1B P04054 1/20 0.38
▸ ATG4B Q9Y4P1 1/20 0.38
▸ ENPP1 P22413 1/20 0.38
▸ MAPT P10636 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ STAT3 P40763 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ PKM P14618 2/20 0.37
▸ NR3C1 P04150 1/20 0.37
▸ MEN1 O00255 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
SCHEMBL20356576 0.93 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1HPGDRXRARXRB
SCHEMBL20356709 0.89 NR4A2 (0.42) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
SCHEMBL20356567 0.89 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1HPGDRXRARXRB
SCHEMBL20356708 0.88 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1KDM4EHPGDPTGER1
SCHEMBL21526008 0.87 PTGER1 (0.43) SMN1; SMN2ALDH1A1HPGDPTGER1LMNA
SCHEMBL21526094 0.87 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1KDM4EHPGDRXRA
SCHEMBL21526079 0.84 GPR132 (0.44) SMN1; SMN2ALDH1A1LMNATP53TDP1
SCHEMBL21525997 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1HPGDLMNATP53
Hydrochloric Acid SCHEMBL21526118 0.83 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1HPGDLMNATP53
SCHEMBL21526040 0.82 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1PTGER1TP53ENPP1

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 2983/4885ALDH1A1 3457/4885KDM4E 4694/4885
US-20200172494-A1 PYRIMIDINE DERIVATIVE GPR39, CFTR, TMEM109 SMN1; SMN2 2983/4885ALDH1A1 3457/4885KDM4E 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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