SCHEMBL21821207

SCHEMBL21821207

O=C(c1ccccc1Cl)n1ncnn1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.51
▸ ELANE P08246 1/20 0.51
▸ KMT2A Q03164 6/20 0.49
▸ CES2 O00748 1/20 0.47
▸ CES1 P23141 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ RAB9A P51151 3/20 0.44
▸ HTT P42858 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ POLB P06746 4/20 0.43
▸ HPGD P15428 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ GAA P10253 1/20 0.40

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
SCHEMBL30356468 0.74 POLB (0.58) PLAUELANEKMT2ACES2CES1
SCHEMBL1682664 0.74 POLB (0.58) PLAUELANEKMT2ACES2CES1
SCHEMBL21821206 0.71 PLAU (0.54) PLAUELANEKMT2ACES2CES1
SCHEMBL13307717 0.71 RAB9A (0.49) PLAUELANEKMT2ACES2CES1
SCHEMBL10723816 0.68 RAB9A (0.80) KMT2AALDH1A1MEN1RXFP1RAB9A
SCHEMBL9426932 0.67 ALDH1A1 (0.57) PLAUELANEKMT2ACES2CES1
SCHEMBL2325272 0.66 CES2 (0.65) KMT2ACES2CES1ALDH1A1MEN1
SCHEMBL50416 0.66 CES2 (0.71) KMT2ACES2CES1ALDH1A1POLB
SCHEMBL7381738 0.66 — —
SCHEMBL31544074 0.66 CES2 (1.00) KMT2ACES2CES1ALDH1A1MEN1

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
CN-118221604-A Process for preparing aryl 2-tetrazol-2-yl ketones with improved selectivity 爱思开生物制药株式会社 2024-06-21 — — CN disclosed
CN-114901647-B Process for preparing aryl 2-tetrazol-2-yl ketones with improved selectivity 爱思开生物制药株式会社 2024-04-02 — — CN disclosed
EP-4048658-A1 METHOD FOR PREPARING ARYL 2-TETRAZOL-2-YL KETONE WITH IMPROVED SELECTIVITY SK Biopharmaceuticals Co., Ltd. (KR) 2022-08-31 — — EP disclosed
CN-114901647-A Method for producing aryl 2-tetrazol-2-yl ketones with improved selectivity 爱思开生物制药株式会社 2022-08-12 — — CN disclosed
US-11236054-B2 Method for preparing aryl 2-tetrazol-1-yl keto with improved selectivity SK BIOPHARMACEUTICALS CO., LTD. (KR) 2022-02-01 — — US disclosed
WO-2021080380-A1 METHOD FOR PREPARING ARYL 2-TETRAZOL-2-YL KETONE WITH IMPROVED SELECTIVITY SK BIOPHARMACEUTICALS CO., LTD. (KR) 2021-04-29 — — WO disclosed
US-20210122719-A1 Method For Preparing Aryl 2-Tetrazol-1-Yl Keto With Improved Selectivity SK BIOPHARMACEUTICALS CO., LTD. 2021-04-29 — — US disclosed
US-10611737-B1 Method for preparing aryl 2-tetrazol-2-yl ketone with improved selectivity SK BIOPHARMACEUTICALS CO., LTD. (KR) 2020-04-07 — — 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 (3 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-20210122719-A1 Method For Preparing Aryl 2-Tetrazol-1-Yl Keto With Improved Selectivity KARS1, TYK2, KYAT1 PLAU 4261/4885ELANE 4742/4885KMT2A 273/4885
US-11236054-B2 Method for preparing aryl 2-tetrazol-1-yl keto with improved selectivity KARS1, TYK2, KYAT1 PLAU 4261/4885ELANE 4742/4885KMT2A 273/4885
US-10611737-B1 Method for preparing aryl 2-tetrazol-2-yl ketone with improved selectivity KARS1, TYK2, TTL PLAU 4008/4885ELANE 4688/4885KMT2A 280/4885

“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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