SCHEMBL14485271

SCHEMBL14485271

NCc1ccc(CNC(=O)OCC2c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
EPHX2 P34913 1/20 0.52
TPSAB1 Q15661 5/20 0.48
PRSS1 P07477 1/20 0.48
TPSD1 Q9BZJ3 1/20 0.48
TPSG1 Q9NRR2 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 1/20 0.47
CYP2C19 P33261 1/20 0.47
CASP3 P42574 1/20 0.44
FABP7 O15540 1/20 0.42
FABP5 Q01469 1/20 0.42
OPRD1 P41143 1/20 0.42
PLG P00747 1/20 0.41

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
Hydrochloric Acid SCHEMBL14485267 0.99 KMT2A (0.57) KMT2AEPHX2TPSAB1PRSS1TPSD1
SCHEMBL6421736 0.90 KMT2A (0.49) KMT2AEPHX2TPSAB1PRSS1TPSD1
SCHEMBL31010055 0.90 KMT2A (0.55) KMT2AEPHX2CASP3FABP7FABP5
SCHEMBL2057615 0.90 KMT2A (0.55) KMT2AEPHX2CASP3FABP7FABP5
SCHEMBL3177417 0.89 KMT2A (0.62) KMT2AEPHX2CASP3FABP7FABP5
SCHEMBL31652901 0.88 KMT2A (0.56) KMT2AEPHX2CASP3FABP7FABP5
SCHEMBL2744319 0.88 KMT2A (0.55) KMT2AEPHX2CASP3FABP7FABP5
SCHEMBL15948331 0.87 KMT2A (0.53) KMT2AEPHX2TPSAB1FABP7FABP5
SCHEMBL118108 0.86 KMT2A (0.56) KMT2AEPHX2CASP3FABP7FABP5
SCHEMBL525564 0.86 KMT2A (0.59) KMT2AEPHX2CASP3FABP7FABP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3788039-B1 FACTOR XIIA INHIBITORS UNIV LEEDS INNOVATIONS LTD (GB) 2026-02-11 EP disclosed
US-12336991-B2 Factor XIIA inhibitors UNIVERSITY OF LEEDS (GB) 2025-06-24 US disclosed
US-20220305011-A1 FACTOR XIIA INHIBITORS UNIVERSITY OF LEEDS (GB) 2022-09-29 US disclosed
US-20210087172-A1 FACTOR XIIa INHIBITORS UNIVERSITY OF LEEDS (GB) 2021-03-25 US disclosed
EP-3788039-A1 FACTOR XIIA INHIBITORS University of Leeds (GB) 2021-03-10 EP disclosed
EP-3773555-A1 FACTOR XIIA INHIBITORS University of Leeds (GB) 2021-02-17 EP disclosed
CN-112204023-A Factor XIIa inhibitors 利兹大学 2021-01-08 CN disclosed
CN-112165938-A Factor XIIA inhibitors 利兹大学 2021-01-01 CN disclosed
EP-2729443-B3 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2020-02-12 EP disclosed
WO-2019186164-A1 FACTOR XIIA INHIBITORS UNIVERSITY OF LEEDS (GB) 2019-10-03 WO disclosed
US-9234000-B2 Benzylamine derivatives as inhibitors of plasma kallikrein KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-01-12 US disclosed
EP-2729443-B1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2015-11-25 EP disclosed
US-20150225450-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LTD (GB) 2015-08-13 US disclosed
US-9051249-B2 Benzylamine derivatives as inhibitors of plasma kallikrein KALVISTA PHARMACEUTICALS LIMITED (GB) 2015-06-09 US disclosed
US-20140213611-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LIMITED (GB) 2014-07-31 US disclosed
EP-2729443-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN Kalvista Pharmaceuticals Limited (GB) 2014-05-14 EP disclosed
WO-2013005045-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KALVISTA PHARMACEUTICALS LIMITED (GB) 2013-01-10 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 (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-20210087172-A1 FACTOR XIIa INHIBITORS F11, F13B, F12 KMT2A 2727/4885EPHX2 647/4885TPSAB1 134/4885
US-20150225450-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK1, BDKRB1 KMT2A 742/4885EPHX2 1235/4885TPSAB1 22/4885
US-20220305011-A1 FACTOR XIIA INHIBITORS F11, F13B, F12 KMT2A 1815/4885EPHX2 199/4885TPSAB1 136/4885
US-12336991-B2 Factor XIIA inhibitors F11, F13B, F12 KMT2A 1815/4885EPHX2 199/4885TPSAB1 136/4885
US-20140213611-A1 BENZYLAMINE DERIVATIVES AS INHIBITORS OF PLASMA KALLIKREIN KLKB1, KLK1, BDKRB1 KMT2A 742/4885EPHX2 1235/4885TPSAB1 22/4885

“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.