SCHEMBL2207016

SCHEMBL2207016

CCC(CC)COc1cccc(C(O)CCN)c1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.43
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL13881574 1.00 AOC3 (0.43) AOC3TP53CYP1A2CYP3A4CYP2C9
SCHEMBL13881637 1.00 AOC3 (0.43) AOC3TP53CYP1A2CYP3A4CYP2C9
SCHEMBL29818852 1.00 AOC3 (0.43) AOC3TP53CYP1A2CYP3A4CYP2C9
SCHEMBL15907831 0.93 MAPK1 (0.42) TP53CYP1A2CYP3A4CYP2C9TSHR
SCHEMBL2205459 0.90 MAPK1 (0.46) TP53CYP1A2CYP3A4CYP2C9TSHR
SCHEMBL13881570 0.90 MAPK1 (0.46) TP53CYP1A2CYP3A4CYP2C9TSHR
SCHEMBL29818796 0.90 MAPK1 (0.46) TP53CYP1A2CYP3A4CYP2C9TSHR
SCHEMBL13881638 0.90 MAPK1 (0.46) TP53CYP1A2CYP3A4CYP2C9TSHR
SCHEMBL4568797 0.89 MAPK1 (0.46) TP53CYP1A2CYP3A4CYP2C9TSHR
SCHEMBL4568974 0.89 MAPK1 (0.46) TP53CYP1A2CYP3A4CYP2C9TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029708-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2024-07-09 US disclosed
US-12029708-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2024-07-09 US disclosed
US-12029708-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2024-07-09 US disclosed
US-11795136-B2 Methods for the treatment of diabetic retinopathy and other ophthalmic diseases ACUCELA INC. (US) 2023-10-24 US disclosed
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 US disclosed
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 US disclosed
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 US disclosed
US-11446261-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2022-09-20 US disclosed
US-20210171435-A1 Methods for the Treatment of Diabetic Retinopathy and other Ophthalmic Diseases ACUCELA INC. 2021-06-10 US disclosed
US-20210077427-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2021-03-18 US disclosed
US-20120122938-A1 Alkoxy Compounds for Disease Treatment ACUCELA INC. (US) 2012-05-17 US disclosed
US-7982071-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2011-07-19 US disclosed
US-7982071-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2011-07-19 US disclosed
US-7982071-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2011-07-19 US disclosed
US-20090326074-A1 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2009-12-31 US disclosed
US-20090326074-A1 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2009-12-31 US disclosed
US-20090326074-A1 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2009-12-31 US disclosed
EP-2091955-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT Acucela, Inc. (US) 2009-08-26 EP disclosed
WO-2009045479-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. (US) 2009-04-09 WO disclosed
WO-2009045479-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. (US) 2009-04-09 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 (8 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-12029708-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER AOC3 173/4885TP53 4092/4885CYP1A2 2936/4885
US-20120122938-A1 Alkoxy Compounds for Disease Treatment ALDH1A2, CLN6, AGER AOC3 173/4885TP53 4092/4885CYP1A2 2936/4885
US-20210077427-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER AOC3 173/4885TP53 4092/4885CYP1A2 2936/4885
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER AOC3 183/4885TP53 4120/4885CYP1A2 2835/4885
US-11795136-B2 Methods for the treatment of diabetic retinopathy and other ophthalmic diseases ALDH1A2, ALDH1A3, RBP4 AOC3 211/4885TP53 4607/4885CYP1A2 4488/4885
US-20210171435-A1 Methods for the Treatment of Diabetic Retinopathy and other Ophthalmic Diseases ALDH1A2, ALDH1A3, RBP4 AOC3 211/4885TP53 4607/4885CYP1A2 4488/4885
US-11446261-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER AOC3 173/4885TP53 4092/4885CYP1A2 2936/4885
US-20090326074-A1 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER AOC3 173/4885TP53 4092/4885CYP1A2 2936/4885

“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.