SCHEMBL15344203

SCHEMBL15344203

Cc1cccc(COc2cccc(C)c2)c1

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 15/20 0.80
▸ MAOA P21397 3/20 0.71
▸ IDO1 P14902 2/20 0.60
▸ ACHE P22303 1/20 0.56
▸ FFAR1 O14842 1/20 0.54
▸ NR1H4 Q96RI1 1/20 0.53
▸ GRM5 P41594 1/20 0.52

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
SCHEMBL1547975 0.96 MAOB (0.74) MAOBMAOAIDO1ACHEFFAR1
SCHEMBL10204868 0.90 MAOB (0.72) MAOBMAOAIDO1FFAR1
SCHEMBL685837 0.90 MAOB (0.68) MAOBMAOA
SCHEMBL15781849 0.90 MAOB (0.67) MAOBMAOAIDO1ACHEFFAR1
SCHEMBL1549250 0.90 MAOB (0.68) MAOBMAOAACHE
SCHEMBL16710548 0.89 MAOB (0.76) MAOBMAOAIDO1ACHEFFAR1
SCHEMBL13144444 0.89 MAOB (0.87) MAOBMAOAIDO1ACHE
Hydrochloric Acid SCHEMBL23235829 0.89 MAOB (0.70) MAOBMAOAIDO1FFAR1
Hydrochloric Acid SCHEMBL23235850 0.89 MAOB (0.70) MAOBMAOAIDO1FFAR1
SCHEMBL8191165 0.88 MAOB (0.69) MAOBMAOAIDO1GRM5

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-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME WUXI APPTEC (HONG KONG) LIMITED (CN) 2023-10-12 — — US disclosed
EP-3204390-B1 SUBSTITUTED PYRIMIDINIUM COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2019-06-05 — — EP disclosed
US-9464096-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2016-10-11 — — US disclosed
US-20160152582-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-06-02 — — US disclosed
US-20160024104-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-01-28 — — US disclosed
US-20160015690-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-01-21 — — US disclosed
US-9096586-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2015-08-04 — — US disclosed
US-9006229-B2 Benzothiazole compounds and their pharmaceutical use GILEAD SCIENCES, INC. (US) 2015-04-14 — — US disclosed
US-8987250-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2015-03-24 — — US disclosed
US-20140045818-A1 BENZOTHIAZOLE COMPOUNDS AND THEIR PHARMACEUTICAL USE GILEAD SCIENCES, INC. (US) 2014-02-13 — — US disclosed
US-20130281434-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-10-24 — — US disclosed
US-20130281433-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2013-10-24 — — 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-20140045818-A1 BENZOTHIAZOLE COMPOUNDS AND THEIR PHARMACEUTICAL USE FURIN, NFATC1, RUNX1 MAOB 2806/4885MAOA 3040/4885IDO1 2269/4885
US-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME FNTA, FDPS, GGPS1 MAOB 4427/4885MAOA 4551/4885IDO1 4767/4885
US-20130281434-A1 THERAPEUTIC COMPOUNDS NFATC1, FURIN, CD4 MAOB 1947/4885MAOA 2386/4885IDO1 3864/4885
US-20160024104-A1 THERAPEUTIC COMPOUNDS NFATC1, FURIN, NPC1 MAOB 3593/4885MAOA 3423/4885IDO1 3642/4885
US-20160015690-A1 THERAPEUTIC COMPOUNDS NQO1, HAVCR2, CCR5 MAOB 802/4885MAOA 1118/4885IDO1 1405/4885
US-20130281433-A1 THERAPEUTIC COMPOUNDS NQO1, HAVCR2, CCR5 MAOB 802/4885MAOA 1118/4885IDO1 1405/4885
US-20160152582-A1 THERAPEUTIC COMPOUNDS NFATC1, FURIN, CD4 MAOB 1947/4885MAOA 2386/4885IDO1 3864/4885

“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.

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