SCHEMBL25817243

SCHEMBL25817243

Cc1cc(C2CCNCC2)c(O)c(C)c1C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.50
GABRA1 P14867 5/20 0.41
GABRB2 P47870 4/20 0.41
QDPR P09417 1/20 0.40
RPS6KA3 P51812 1/20 0.38
HTR6 P50406 2/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 1/20 0.35
HTR1A P08908 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35

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
SCHEMBL31131399 0.71 HTR2C (0.58) HTR2CGABRA1GABRB2QDPRHTR6
SCHEMBL13749404 0.71 HTR2C (0.58) HTR2CGABRA1GABRB2QDPRHTR6
SCHEMBL19347098 0.71 HTR2C (0.58) HTR2CGABRA1GABRB2QDPRHTR6
SCHEMBL25817270 0.70 HTR2C (0.42) HTR2CGABRA1GABRB2HTR6SLC6A2
SCHEMBL21808459 0.70 KDM4E (0.42)
SCHEMBL25817289 0.70 HTR2C (0.42) HTR2CGABRA1GABRB2HTR6SLC6A2
Hydrochloric Acid SCHEMBL25328473 0.70 HTR2C (0.59) HTR2CGABRA1GABRB2QDPRHTR6
Hydrochloric Acid SCHEMBL30493296 0.70 HTR2C (0.59) HTR2CGABRA1GABRB2QDPRHTR6
SCHEMBL10698817 0.69 KDM4E (0.41)
SCHEMBL11705589 0.69 KDM4E (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820778-B2 2-azaspiro[3.4]octane derivatives as M4 agonists NOVARTIS AG (CH) 2023-11-21 US disclosed
US-20230212139-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH, INC. 2023-07-06 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-20230212139-A1 2-AZASPIRO[3.4]OCTANE DERIVATIVES AS M4 AGONISTS CHRM2, CHRM1, CHRM3 HTR2C 374/4885GABRA1 328/4885GABRB2 432/4885
US-11820778-B2 2-azaspiro[3.4]octane derivatives as M4 agonists CHRM2, CHRM1, CHRM3 HTR2C 374/4885GABRA1 328/4885GABRB2 432/4885

“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.