SCHEMBL4569113

SCHEMBL4569113

CC(=O)CCCOc1cccc(OCCN2C(=O)c3ccccc3C2=O)c1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.69
RAB9A P51151 6/20 0.66
TDP1 Q9NUW8 2/20 0.66
KMT2A Q03164 2/20 0.66
HPGD P15428 4/20 0.57
NPSR1 Q6W5P4 1/20 0.57
MAPT P10636 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPC1 O15118 2/20 0.52
TSHR P16473 3/20 0.50
POLB P06746 1/20 0.50
APEX1 P27695 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MAPK1 P28482 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
HEXA P06865 1/20 0.47
HEXB P07686 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
SCHEMBL4569072 0.87 RAB9A (0.53) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL8898105 0.86 L3MBTL1 (0.74) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL4572136 0.85 RAB9A (0.64) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL2208178 0.84 RAB9A (0.68) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL2204905 0.83 RAB9A (0.71) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL2208243 0.83 RAB9A (0.71) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL2205237 0.83 RAB9A (0.71) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL4569116 0.82 RAB9A (0.74) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL2210883 0.81 RAB9A (0.72) L3MBTL1RAB9ATDP1KMT2AHPGD
SCHEMBL4569045 0.80 RAB9A (1.00) L3MBTL1RAB9ATDP1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180177746-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2018-06-28 US disclosed
US-9737496-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2017-08-22 US disclosed
US-20170049722-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2017-02-23 US disclosed
US-9458088-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2016-10-04 US disclosed
US-20150239825-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2015-08-27 US disclosed
US-20150239836-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2015-08-27 US disclosed
US-8993807-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2015-03-31 US disclosed
US-8981153-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2015-03-17 US disclosed
US-8829244-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2014-09-09 US disclosed
US-20130197096-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA, INC. (US) 2013-08-01 US disclosed
US-20120129894-A1 Alkoxy Compounds for Disease Treatment ACUCELA INC. (US) 2012-05-24 US disclosed
US-20120122938-A1 Alkoxy Compounds for Disease Treatment ACUCELA INC. (US) 2012-05-17 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 (7 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-20150239836-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER L3MBTL1 2398/4885RAB9A 2120/4885TDP1 499/4885
US-20120122938-A1 Alkoxy Compounds for Disease Treatment ALDH1A2, CLN6, AGER L3MBTL1 2398/4885RAB9A 2120/4885TDP1 499/4885
US-20150239825-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER L3MBTL1 2398/4885RAB9A 2120/4885TDP1 499/4885
US-20130197096-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER L3MBTL1 2398/4885RAB9A 2120/4885TDP1 499/4885
US-20170049722-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER L3MBTL1 2398/4885RAB9A 2120/4885TDP1 499/4885
US-20180177746-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER L3MBTL1 2398/4885RAB9A 2120/4885TDP1 499/4885
US-20120129894-A1 Alkoxy Compounds for Disease Treatment ALDH1A2, CLN6, AGER L3MBTL1 2398/4885RAB9A 2120/4885TDP1 499/4885

“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.