SCHEMBL25133591

SCHEMBL25133591

CC(NC(C)(C)C)c1ccc(N2CCN(C(=O)COCCC(C)(C)C)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ MAPT P10636 7/20 0.43
▸ HTT P42858 2/20 0.43
▸ GRM5 P41594 4/20 0.42
▸ MAPK1 P28482 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ ME2 P23368 1/20 0.38
▸ ME1 P48163 1/20 0.38
▸ ME3 Q16798 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ NAMPT P43490 1/20 0.38

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
SCHEMBL24856050 0.83 MAPT (0.43) ALDH1A1MAPTHTTMAPK1KDM4E
SCHEMBL18592219 0.81 ALDH1A1 (0.48) ALDH1A1MAPTHTTGRM5MAPK1
SCHEMBL18591772 0.72 SLC6A2 (0.40) —
SCHEMBL18530398 0.71 MAPT (0.41) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL18530448 0.71 MAPT (0.41) ALDH1A1MAPTHTTKDM4ELMNA
SCHEMBL20330004 0.71 SLC6A2 (0.41) ALDH1A1KDM4EGAATSHR
SCHEMBL23544874 0.69 MAPT (0.64) ALDH1A1MAPTHTTMAPK1KDM4E
SCHEMBL27089708 0.69 ME2 (0.52) ALDH1A1MAPTHTTMAPK1KDM4E
SCHEMBL22965356 0.69 ALDH1A1 (0.50) ALDH1A1MAPTHTTGRM5MAPK1
SCHEMBL24267145 0.68 ACACB (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230097358-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2023-03-30 — — 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 (1 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-20230097358-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE LRRK2, CRBN, MDM2 ALDH1A1 3531/4885MAPT 403/4885HTT 298/4885

“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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