SCHEMBL25554382

SCHEMBL25554382

CCCCCCCCNCCNC[C@H]1CCC(=O)N1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.44
GNAO1 P09471 2/20 0.44
GNAI1 P63096 2/20 0.44
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
CD274 Q9NZQ7 11/20 0.36
PDCD1 Q15116 3/20 0.36
PDCD1LG2 Q9BQ51 8/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
DRD4 P21917 1/20 0.35
DRD5 P21918 1/20 0.35
DRD3 P35462 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
SCHEMBL24121619 0.97 GNAI3 (0.46) GNAI3GNAO1GNAI1ALDH1A1TSHR
SCHEMBL21290766 0.84 CD274 (0.40) CD274PDCD1PDCD1LG2
SCHEMBL21290754 0.84 CD274 (0.40) CD274PDCD1PDCD1LG2
SCHEMBL21673405 0.77 CD274 (0.43) CD274PDCD1PDCD1LG2
SCHEMBL21290617 0.77 CD274 (0.43) CD274PDCD1PDCD1LG2
SCHEMBL5175881 0.76 ALDH1A1 (0.53) ALDH1A1L3MBTL1
SCHEMBL5872353 0.76 ALDH1A1 (0.53) ALDH1A1L3MBTL1
SCHEMBL22201153 0.76 ALDH1A1 (0.53) ALDH1A1L3MBTL1
SCHEMBL22190342 0.76 ALDH1A1 (0.53) ALDH1A1L3MBTL1
SCHEMBL9646435 0.76 ALDH1A1 (0.53) ALDH1A1L3MBTL1

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-20230159532-A1 PARATHYROID HORMONE (PTH) RECEPTOR ANTAGONISTS AND USES THEREOF Crinetics Pharmaceuticals, Inc. 2023-05-25 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-20230159532-A1 PARATHYROID HORMONE (PTH) RECEPTOR ANTAGONISTS AND USES THEREOF PTH1R, CALCR, VDR GNAI3 1189/4885GNAO1 1221/4885GNAI1 1220/4885

“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.