SCHEMBL23919065

SCHEMBL23919065

CC(C)(C)CCN1CCC(CN2CCNCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNAO1 P09471 4/20 0.43
SIGMAR1 Q99720 1/20 0.41
CACNA1I Q9P0X4 7/20 0.39
KCNH2 Q12809 5/20 0.39
ACHE P22303 1/20 0.38
RAD52 P43351 1/20 0.37
CNR1 P21554 1/20 0.36
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GNAI3 P08754 3/20 0.35
GNAI1 P63096 3/20 0.35
CHRM5 P08912 1/20 0.34
ADRA2C P18825 1/20 0.34
CXCR4 P61073 1/20 0.34

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
SCHEMBL23919059 0.88 GNAO1 (0.44) GNAO1SIGMAR1CACNA1IKCNH2ACHE
SCHEMBL23919057 0.84 SIGMAR1 (0.41) GNAO1SIGMAR1RAD52CNR1POLB
SCHEMBL21472825 0.84 ACHE (0.39) GNAO1SIGMAR1ACHERAD52CHRM5
SCHEMBL26972265 0.84 CHRM5 (0.53) CACNA1IKCNH2ACHECNR1SMN1; SMN2
SCHEMBL22166533 0.84 CACNA1I (0.40) GNAO1CACNA1IKCNH2ACHECNR1
SCHEMBL2600051 0.83 SIGMAR1 (0.52) GNAO1SIGMAR1RAD52POLBSMN1; SMN2
SCHEMBL20314499 0.83 CACNA1I (0.39) GNAO1CACNA1IKCNH2ACHECNR1
SCHEMBL23867106 0.82 GNAO1 (0.49) GNAO1ACHERAD52POLBSMN1; SMN2
SCHEMBL25026639 0.82 NCF1 (0.43) GNAO1SIGMAR1ACHERAD52POLB
SCHEMBL20314514 0.81 CACNA1I (0.39) GNAO1CACNA1IKCNH2ACHECNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2024-01-02 US disclosed
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 (3 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 GNAO1 2111/4885SIGMAR1 3941/4885CACNA1I 4058/4885
US-20230097358-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE LRRK2, CRBN, MDM2 GNAO1 2111/4885SIGMAR1 3941/4885CACNA1I 4058/4885
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use LRRK2, ADRM1, CRBN GNAO1 1639/4885SIGMAR1 3038/4885CACNA1I 4452/4885

“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.