SCHEMBL23032155

SCHEMBL23032155

CCN1CCC[C@@H]1c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.46
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
SLC6A3 Q01959 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL11510524 0.91 OPRK1 (0.48) ALDH1A1TSHR
SCHEMBL20349553 0.83 TRPA1 (0.49) KDM4EALDH1A1LMNAMAPT
SCHEMBL23423397 0.82 CHRNB2 (0.59) DRD2
SCHEMBL23032150 0.82 CHRNB2 (0.59) DRD2
SCHEMBL13407277 0.82 CHRNB2 (0.59) DRD2
SCHEMBL19275748 0.81 ALDH1A1 (0.49) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL18862021 0.80 OPRK1 (0.52) DRD2ALDH1A1
SCHEMBL13842760 0.79 HRH3 (0.46) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL23064641 0.79 DRD2 (0.54) DRD2KDM4EALDH1A1GAATSHR
SCHEMBL4949268 0.78 CFB (0.36) DRD2

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-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) 2021-02-25 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-20210054007-A1 RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF TACR1, TACR2, GPBAR1 DRD2 1040/4885KDM4E 3486/4885ALDH1A1 1113/4885

“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.