SCHEMBL19923313

SCHEMBL19923313

CC(C)COc1ccc(N)cc1C(C)C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.69
▸ GAA P10253 3/20 0.69
▸ TLR8 Q9NR97 1/20 0.43
▸ MAPT P10636 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ RXRA P19793 2/20 0.41
▸ KDM1A O60341 1/20 0.40
▸ TP53 P04637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ XDH P47989 2/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37
▸ RXRB P28702 1/20 0.37

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
SCHEMBL10238812 0.85 GAA (0.58) ALDH1A1GAATLR8MAPTKDM4E
SCHEMBL9570228 0.83 ALDH1A1 (0.96) ALDH1A1GAATLR8MAPTKDM4E
SCHEMBL8134520 0.81 ALDH1A1 (0.73) ALDH1A1GAATLR8MAPTKDM4E
SCHEMBL27645331 0.81 GAA (0.45) ALDH1A1GAAMAPTKDM4ETP53
SCHEMBL5866593 0.80 ALDH1A1 (0.71) ALDH1A1GAATLR8MAPTKDM4E
SCHEMBL10187288 0.79 ALDH1A1 (0.80) ALDH1A1GAATLR8MAPTKDM4E
SCHEMBL17366264 0.79 ALDH1A1 (0.69) ALDH1A1GAATLR8MAPTKDM4E
SCHEMBL7265202 0.79 ALDH1A1 (0.80) ALDH1A1GAATLR8MAPTKDM4E
SCHEMBL278545 0.79 KDM1A (0.54) ALDH1A1GAAMAPTRXRAKDM1A
SCHEMBL2973838 0.77 GAA (0.52) ALDH1A1GAAMAPTKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230322688-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-10-12 — — US disclosed
US-10787421-B2 Substituted anilines for treatment of animal diseases ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2020-09-29 — — US disclosed
US-10787421-B2 Substituted anilines for treatment of animal diseases ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2020-09-29 — — US disclosed
US-20190218190-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-07-18 — — US disclosed
US-20190218190-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-07-18 — — US disclosed
US-10221143-B2 Substituted anilines for treatment of animal diseases ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-03-05 — — US disclosed
US-10221143-B2 Substituted anilines for treatment of animal diseases ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2019-03-05 — — US disclosed
US-20180065936-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-03-08 — — US disclosed
US-20180065936-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-03-08 — — US disclosed
US-20180065936-A1 THERAPEUTIC COMPOUNDS ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-03-08 — — 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-20230322688-A1 THERAPEUTIC COMPOUNDS IL5, IL15, IL4 ALDH1A1 495/4885GAA 2087/4885TLR8 1831/4885
US-10787421-B2 Substituted anilines for treatment of animal diseases IL5, IL4, IL15 ALDH1A1 424/4885GAA 1979/4885TLR8 1433/4885
US-20190218190-A1 THERAPEUTIC COMPOUNDS IL5, IL4, IL15 ALDH1A1 692/4885GAA 2104/4885TLR8 1551/4885
US-20180065936-A1 THERAPEUTIC COMPOUNDS IL5, IL4, IL15 ALDH1A1 692/4885GAA 2104/4885TLR8 1551/4885
US-10221143-B2 Substituted anilines for treatment of animal diseases IL5, IL4, IL15 ALDH1A1 513/4885GAA 1942/4885TLR8 700/4885

“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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