SCHEMBL4680240

SCHEMBL4680240

CC(C)(C)C(NC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.65
SLC1A2 P43004 1/20 0.50
CCR1 P32246 1/20 0.50
PRSS1 P07477 3/20 0.49
CTSG P08311 3/20 0.49
CTRB1 P17538 3/20 0.49
CMA1 P23946 3/20 0.49
LMNA P02545 3/20 0.49
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 2/20 0.46
RAB9A P51151 1/20 0.46
ADAM17 P78536 1/20 0.46
POLB P06746 1/20 0.46
HDAC3 O15379 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
IDO1 P14902 1/20 0.45
ALOX15 P16050 1/20 0.45
HDAC1 Q13547 1/20 0.45

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
SCHEMBL7897280 1.00 CA2 (0.65) CA2SLC1A2CCR1PRSS1CTSG
SCHEMBL31540126 0.89 SLC1A2 (0.53) CA2SLC1A2CTRB1LMNAALDH1A1
SCHEMBL15260867 0.86 CA2 (0.66) CA2LMNAALDH1A1SMN1; SMN2HPGD
SCHEMBL11812665 0.86 CTRB1 (0.50) CA2SLC1A2PRSS1CTSGCTRB1
SCHEMBL4681864 0.86 CA2 (0.54) CA2SLC1A2CCR1PRSS1CTSG
SCHEMBL4680332 0.84 CA2 (0.64) CA2CCR1LMNAALDH1A1SMN1; SMN2
SCHEMBL10118947 0.84 CA2 (0.52) CA2CCR1ALDH1A1SMN1; SMN2ADAM17
SCHEMBL8638326 0.82 CA2 (0.55) CA2RAB9AADAM17HDAC3HDAC1
SCHEMBL21310010 0.82 CA2 (0.61) CA2CCR1ALDH1A1SMN1; SMN2CA1
SCHEMBL10893431 0.81 SLC1A2 (0.50) CA2SLC1A2CTRB1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257388-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. (US) 2023-08-17 US disclosed
US-11667645-B2 Granzyme B directed imaging and therapy CYTOSITE BIOPHARMA INC. (US) 2023-06-06 US disclosed
CN-112261939-A Granzyme B directed imaging and therapy 塞托赛特生物制药股份有限公司 2021-01-22 CN disclosed
EP-3752145-A1 GRANZYME B DIRECTED IMAGING AND THERAPY Cytosite Biopharma Inc. (US) 2020-12-23 EP disclosed
US-20200369673-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. 2020-11-26 US disclosed
WO-2019160916-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. (US) 2019-08-22 WO disclosed
EP-1392655-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2008-07-16 EP disclosed
EP-1198456-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2007-09-19 EP disclosed
EP-1392655-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2004-03-03 EP disclosed
US-6645968-B2 E.g., N-(1-((anilinocarbonyl)amino)-2,2,2-trichloroethyl)-4-methyl-benzamide; antiepileptic, -ischemic and cardiotonic agents; sexual, eating and urogenital disorders; asthma; migraines; ABBOTT LABORATORIES 2003-11-11 US disclosed
WO-2002062762-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO disclosed
EP-1198456-A2 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2002-04-24 EP disclosed
US-20020028836-A1 Potassium channel openers ABBVIE INC. 2002-03-07 US disclosed
WO-2001009096-A2 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2001-02-08 WO disclosed
US-6180374-B1 ENANTIOMORPHS; BIOTRANSFORMATION USING ENZYME IN PRESENCE OF AN ALCOHOL OF AN AZLACTONE CHIROTECH TECHNOLOGY, INC. (GB) 2001-01-30 US disclosed
EP-0726891-B1 A METHOD FOR PREPARING TERT-LEUCINE AND ANALOGUES THEREOF IN ENANTIOMERIC FORM, AND INTERMEDIATES THEREIN CHIROTECH TECHNOLOGY LTD (GB) 1999-02-03 EP disclosed
EP-0726891-A1 A METHOD FOR PREPARING $i(TERT)-LEUCINE AND ANALOGUES THEREOF IN ENANTIOMERIC FORM, AND INTERMEDIATES THEREIN Chiroscience Limited (GB) 1996-08-21 EP disclosed
WO-1995012573-A1 A METHOD FOR PREPARING TERT-LEUCINE AND ANALOGUES THEREOF IN ENANTIOMERIC FORM, AND INTERMEDIATES THEREIN CHIROSCIENCE LIMITED (GB) 1995-05-11 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 (4 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-20020028836-A1 Potassium channel openers KCNJ2, KCNJ11, KCNJ1 CA2 369/4885SLC1A2 243/4885CCR1 4547/4885
US-20230257388-A1 GRANZYME B DIRECTED IMAGING AND THERAPY GZMB, PRF1, CTSB CA2 1885/4885SLC1A2 4468/4885CCR1 545/4885
US-20200369673-A1 GRANZYME B DIRECTED IMAGING AND THERAPY GZMB, PRF1, CTSB CA2 1885/4885SLC1A2 4468/4885CCR1 545/4885
US-11667645-B2 Granzyme B directed imaging and therapy GZMB, PRF1, CTSB CA2 1885/4885SLC1A2 4468/4885CCR1 545/4885

“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.