SCHEMBL2204716

SCHEMBL2204716

Cc1cccc(C)c1COc1cccc(CCCN)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 3/20 0.56
TAAR1 Q96RJ0 1/20 0.47
MAOB P27338 3/20 0.45
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
MGLL Q99685 1/20 0.42
BCHE P06276 2/20 0.42
NOS1 P29475 2/20 0.41
NOS2 P35228 2/20 0.41
NOS3 P29474 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
FFAR1 O14842 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
SCHEMBL4568940 0.87 SLC22A12 (0.57) SLC22A12CYP4F2CYP4A11MGLLBCHE
SCHEMBL3450066 0.84 SLC22A12 (0.55) SLC22A12CYP4F2CYP4A11MGLLBCHE
SCHEMBL15297885 0.83 SLC22A12 (0.60) SLC22A12MAOBCYP4F2CYP4A11BCHE
SCHEMBL2207306 0.82 MAOB (0.59) TAAR1MAOBCYP4F2CYP4A11MGLL
SCHEMBL2204528 0.82 SMN1; SMN2 (0.46) TAAR1MAOBCYP4F2CYP4A11MGLL
SCHEMBL2206195 0.81 CYP4F2 (0.66) MAOBCYP4F2CYP4A11MGLLBCHE
SCHEMBL954242 0.81 FFAR1 (0.54) SLC22A12PPARGPPARAFFAR1
SCHEMBL959881 0.80 CYSLTR2 (0.58) SLC22A12PPARGPPARAFFAR1
SCHEMBL14640150 0.80 TAAR1 (0.54) TAAR1PPARGPPARA
SCHEMBL15297886 0.80 SLC22A12 (0.57) SLC22A12MAOBCYP4F2CYP4A11BCHE

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 70 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-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-20210077427-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2021-03-18 US disclosed
US-20210077427-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2021-03-18 US disclosed
US-10639286-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2020-05-05 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 (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-12029708-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER SLC22A12 769/4885TAAR1 1482/4885MAOB 318/4885
US-20120122938-A1 Alkoxy Compounds for Disease Treatment ALDH1A2, CLN6, AGER SLC22A12 769/4885TAAR1 1482/4885MAOB 318/4885
US-20210077427-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER SLC22A12 769/4885TAAR1 1482/4885MAOB 318/4885
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER SLC22A12 753/4885TAAR1 1463/4885MAOB 332/4885
US-11446261-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER SLC22A12 769/4885TAAR1 1482/4885MAOB 318/4885
US-20090326074-A1 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER SLC22A12 769/4885TAAR1 1482/4885MAOB 318/4885
US-10639286-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER SLC22A12 769/4885TAAR1 1482/4885MAOB 318/4885

“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.