SCHEMBL23919055

SCHEMBL23919055

CC(C)(C)CN1CCN(CC2CCNCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 1/20 0.40
CACNA1B Q00975 1/20 0.40
CACNB1 Q02641 1/20 0.40
GBA1 P04062 2/20 0.39
GNAO1 P09471 5/20 0.38
CHRM5 P08912 1/20 0.36
ADRA2C P18825 1/20 0.36
ACHE P22303 3/20 0.36
HTR4 Q13639 1/20 0.34
GNAI3 P08754 4/20 0.31
GNAI1 P63096 4/20 0.31
CNR2 P34972 2/20 0.30

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
SCHEMBL25133512 0.93 CHRM5 (0.42) CACNA2D1CACNA1BCACNB1GBA1GNAO1
SCHEMBL25133300 0.89 SLC6A1 (0.34) CACNA2D1CACNA1BCACNB1GBA1GNAO1
SCHEMBL25133303 0.89 SLC6A1 (0.34) CACNA2D1CACNA1BCACNB1GBA1GNAO1
SCHEMBL25133298 0.89 SLC6A1 (0.34) CACNA2D1CACNA1BCACNB1GBA1GNAO1
SCHEMBL21472825 0.87 ACHE (0.39) CACNA2D1CACNA1BCACNB1GBA1GNAO1
SCHEMBL16282944 0.86 CHRM5 (0.43) CHRM5ADRA2CACHE
SCHEMBL14422030 0.84 GBA1 (0.48) CACNA2D1CACNA1BCACNB1GBA1GNAO1
SCHEMBL23919059 0.84 GNAO1 (0.44) CACNA2D1CACNA1BCACNB1GBA1GNAO1
SCHEMBL23765778 0.82 GNAO1 (0.36) GNAO1GNAI3GNAI1
Hydrochloric Acid SCHEMBL5573130 0.82 GBA1 (0.47) CACNA2D1CACNA1BCACNB1GBA1GNAO1

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 2 patents. 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
US-20210315896-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2021-10-14 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 (2 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-20210315896-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE LRRK2, CRBN, MDM2 CACNA2D1 3469/4885CACNA1B 3234/4885CACNB1 2077/4885
US-20230097358-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE LRRK2, CRBN, MDM2 CACNA2D1 3469/4885CACNA1B 3234/4885CACNB1 2077/4885

“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.