SCHEMBL3626811

SCHEMBL3626811

O=Cc1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.72
MAPT P10636 5/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
HPGD P15428 4/20 0.60
NPSR1 Q6W5P4 1/20 0.60
NPC1 O15118 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.53
ALDH1A1 P00352 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C19 P33261 2/20 0.49
POLB P06746 1/20 0.49
APEX1 P27695 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
KMT2A Q03164 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL28591026 0.96 RAB9A (0.66) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL13969475 0.94 RAB9A (0.64) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL7489809 0.93 HPGD (0.70) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL30084003 0.93 HPGD (0.70) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL12413497 0.88 HEXA (0.61) RAB9AMAPTSMN1; SMN2POLBHSD17B10
SCHEMBL4728037 0.87 HPGD (0.59) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL24153517 0.87 RAB9A (0.66) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL5277782 0.85 RAB9A (0.67) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL7299163 0.84 RAB9A (1.00) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL8298007 0.83 RAB9A (0.79) RAB9AMAPTSMN1; SMN2HPGDNPSR1

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542267-B2 Cryptate compounds AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2023-01-03 US disclosed
US-11535623-B2 Cryptate compounds AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2022-12-27 US disclosed
US-11535623-B2 Cryptate compounds AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2022-12-27 US disclosed
US-20200308183-A1 CRYPTATE COMPOUNDS AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2020-10-01 US disclosed
US-20200308182-A1 CRYPTATE COMPOUNDS AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2020-10-01 US disclosed
US-20200308183-A1 CRYPTATE COMPOUNDS AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2020-10-01 US disclosed
US-10717741-B2 Cryptate compounds AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2020-07-21 US disclosed
US-10717741-B2 Cryptate compounds AUSTRALIAN NUCLEAR SCIENCE AND TECHNOLOGY ORGANISATION (AU) 2020-07-21 US disclosed
EP-2729467-B1 CRYPTATE COMPOUNDS AND METHODS FOR THEIR PREPARATION AUSTRALIAN NUCLEAR SCIENCE TEC (AU) 2016-10-12 EP disclosed
US-9249306-B2 Quenched dendrimeric dyes for florescence detection CARNEGIE MELLON UNIVERSITY (US) 2016-02-02 US disclosed
EP-1506208-A4 1,1- AND 1,2-BISPHOSPHONATES AS APOLIPOPROTEIN E MODULATORS ILEX PRODUCTS INC (US) 2006-05-24 EP disclosed
EP-1506208-A2 1,1- AND 1,2-BISPHOSPHONATES AS APOLIPOPROTEIN E MODULATORS Ilex Products, Inc. (US) 2005-02-16 EP disclosed
WO-2003094851-A2 1,1- AND 1,2-BISPHOSPHONATES AS APOLIPROTEIN E MODULATORS ILEX PRODUCTS, INC. (US) 2003-11-20 WO disclosed
US-5962460-A CONTROLLING CANCER GROWTH NATIONAL SCIENCE COUNCIL (TAIWAN) (TW) 1999-10-05 US disclosed
US-5478851-A Hyperglycemic agent and antilipemic agent BEECHAM GROUP PLC (GB) 1995-12-26 US disclosed
EP-0555264-A1 NOVEL COMPOUNDS BEECHAM GROUP plc (GB) 1993-08-18 EP disclosed
WO-1992007850-A1 NOVEL COMPOUNDS BEECHAM GROUP PLC (GB) 1992-05-14 WO disclosed
US-4764612-A SELECTIVE HISTAMINE H2-ANTAGONIST GLAXO GROUP LIMITED (GB) 1988-08-16 US disclosed
US-4442110-A ANTISECRETORY, ANTIALLERGEN, ANTIINFLAMMATORY, ANTIULCER GLAXO GROUP LIMITED (GB) 1984-04-10 US disclosed
US-4318913-A 1,2,4-Triazole-3,5-diamine derivatives GLAXO GROUP LIMITED (GB) 1982-03-09 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-20200308183-A1 CRYPTATE COMPOUNDS HCCS, SQOR, NQO1 RAB9A 2192/4885MAPT 3255/4885SMN1; SMN2 3013/4885
US-11542267-B2 Cryptate compounds HCCS, SQOR, NQO1 RAB9A 2192/4885MAPT 3255/4885SMN1; SMN2 3013/4885
US-20200308182-A1 CRYPTATE COMPOUNDS HCCS, SQOR, NQO1 RAB9A 2192/4885MAPT 3255/4885SMN1; SMN2 3013/4885
US-10717741-B2 Cryptate compounds HCCS, SQOR, NQO1 RAB9A 2192/4885MAPT 3255/4885SMN1; SMN2 3013/4885
US-11535623-B2 Cryptate compounds HCCS, SQOR, NQO1 RAB9A 2192/4885MAPT 3255/4885SMN1; SMN2 3013/4885

“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.