SCHEMBL26239366

SCHEMBL26239366

CC(S)OCCCN1CC[C@@H](O)C1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.47
HRH2 P25021 5/20 0.44
HRH1 P35367 5/20 0.44
HTR1A P08908 1/20 0.42
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
LTA4H P09960 1/20 0.37
ACHE P22303 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
SCHEMBL21667892 0.87 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL9917378 0.87 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL9917377 0.87 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL13542804 0.83 HRH3 (0.46) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL13543540 0.83 HRH3 (0.46) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL24114470 0.78 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL12717290 0.78 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL9921265 0.78 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL20729439 0.78 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1
SCHEMBL13552419 0.78 HRH3 (0.49) HRH3HRH2HRH1HTR1APDCD1

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-11759458-B2 Indane-amines as PD-L1 antagonists CHEMOCENTRYX, INC. (US) 2023-09-19 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-11759458-B2 Indane-amines as PD-L1 antagonists CD274, PDCD1LG2, PDCD1 HRH3 11/4885HRH2 21/4885HRH1 18/4885

“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.