SCHEMBL25510489

SCHEMBL25510489

CCC1CCN(c2nc(C)ccc2C(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
USP1 O94782 6/20 0.36
WDR48 Q8TAF3 5/20 0.36
PDE10A Q9Y233 1/20 0.36
PIK3CA P42336 2/20 0.35
MTOR P42345 2/20 0.35
CDK1 P06493 1/20 0.34
MC4R P32245 1/20 0.34
HRH4 Q9H3N8 1/20 0.33
OPRK1 P41145 1/20 0.33
TSHR P16473 1/20 0.33
ACACB O00763 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL25510491 0.83 TSHR (0.49) TSHRKDM4EALDH1A1MEN1LMNA
SCHEMBL25510487 0.81 CYP1A2 (0.42) CHRM3PDE4APDE4BPDE4CPDE4D
SCHEMBL25510486 0.80 SMN1; SMN2 (0.41) CHRM3PDE4APDE4BPDE4CPDE4D
SCHEMBL20365554 0.77 ALDH1A1 (0.46) KDM4EALDH1A1MEN1KMT2A
SCHEMBL26846112 0.73 HRH4 (0.37) USP1WDR48PDE10AHRH4ACACB
SCHEMBL26789071 0.72 MAPK8 (0.41) CHRM3PDE4APDE4BPDE4CPDE4D
SCHEMBL25453138 0.70 CDK1 (0.40) CDK1MEN1LMNAKMT2AHRH3
SCHEMBL26792083 0.70 CDK1 (0.40) CDK1ACACBMEN1KMT2AHRH3
SCHEMBL23483081 0.67 HRH3 (0.57) CDK1TSHRKDM4EALDH1A1MEN1
SCHEMBL23565849 0.67 KDM4E (0.39) USP1WDR48KDM4EALDH1A1HRH3

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-20230147428-A1 BENZIMIDAZOLONE-BASED CINNAMAMIDE DERIVATIVE AS TRPV1 ANTAGONIST AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OR PREVENTION OF PAIN CONTAINING SAME AS ACTIVE INGREDIENT JMACKEM CO., LTD (KR) 2023-05-11 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-20230147428-A1 BENZIMIDAZOLONE-BASED CINNAMAMIDE DERIVATIVE AS TRPV1 ANTAGONIST AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OR PREVENTION OF PAIN CONTAINING SAME AS ACTIVE INGREDIENT TRPV1, TRPA1, TRPV5 CHRM3 1281/4885PDE4A 912/4885PDE4B 1075/4885

“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.