SCHEMBL18748443

SCHEMBL18748443

Nc1nc(N)c(C(=O)NC[C@@H](CNC(=O)OCc2ccccc2)Cc2ccccc2)nc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 4/20 0.48
▸ SCNN1A P37088 8/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ GLA P06280 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ THPO P40225 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ FTO Q9C0B1 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ GMNN O75496 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ PMP22 Q01453 1/20 0.47

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
SCHEMBL18748462 0.88 SCNN1A (0.45) PLAUSCNN1AALDH1A1KDM4EGLA
SCHEMBL18748452 0.86 SCNN1A (0.46) SCNN1AALDH1A1KDM4EGLAHPGD
SCHEMBL18748449 0.86 SCNN1A (0.46) SCNN1AALDH1A1KDM4EGLAHPGD
SCHEMBL18760196 0.85 SCNN1A (0.51) PLAUSCNN1AALDH1A1KDM4EGLA
SCHEMBL18748442 0.85 SCNN1A (0.53) PLAUSCNN1AALDH1A1KDM4EGLA
SCHEMBL17108573 0.85 SCNN1A (0.53) PLAUSCNN1AALDH1A1KDM4EGLA
SCHEMBL18748447 0.85 SCNN1A (0.53) PLAUSCNN1AALDH1A1KDM4EGLA
SCHEMBL18748444 0.83 SCNN1A (0.49) PLAUSCNN1AALDH1A1KDM4EGLA
SCHEMBL1428415 0.80 SCNN1A (0.55) SCNN1AALDH1A1KDM4EGLAHPGD
SCHEMBL11959313 0.77 SCNN1A (0.51) PLAUSCNN1AALDH1A1KDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954211-B2 Chemical compounds ASTRAZENECA AB (SE) 2021-03-23 — — US disclosed
US-20190330187-A1 Chemical Compounds ASTRAZENECA UK LIMITED (GB) 2019-10-31 — — US disclosed
US-10336725-B2 Chemical compounds ASTRAZENECA AB (SE) 2019-07-02 — — US disclosed
US-20180162838-A1 Chemical Compounds ASTRAZENECA AB (SE) 2018-06-14 — — US disclosed
US-20180162838-A1 Chemical Compounds ASTRAZENECA AB (SE) 2018-06-14 — — US disclosed
US-9873678-B2 Chemical compounds ASTRAZENECA AB (SE) 2018-01-23 — — US disclosed
US-9873678-B2 Chemical compounds ASTRAZENECA AB (SE) 2018-01-23 — — US disclosed
US-20170107195-A1 Chemical Compounds ASTRAZENECA AB (SE) 2017-04-20 — — US disclosed
US-20170107195-A1 Chemical Compounds ASTRAZENECA AB (SE) 2017-04-20 — — 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-20170107195-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A PLAU 4370/4885SCNN1A 3/4885ALDH1A1 933/4885
US-10336725-B2 Chemical compounds CFTR, SCNN1B, SCNN1A PLAU 4370/4885SCNN1A 3/4885ALDH1A1 933/4885
US-20180162838-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A PLAU 4370/4885SCNN1A 3/4885ALDH1A1 933/4885
US-10954211-B2 Chemical compounds CFTR, SCNN1B, SCNN1A PLAU 4370/4885SCNN1A 3/4885ALDH1A1 933/4885
US-20190330187-A1 Chemical Compounds CFTR, SCNN1B, SCNN1A PLAU 4370/4885SCNN1A 3/4885ALDH1A1 933/4885

“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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