SCHEMBL3316141

SCHEMBL3316141

CN[C@@H]1CCN(C)C[C@@H]1F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 7/20 0.35
SSTR1 P30872 4/20 0.35
NCF1 P14598 1/20 0.32
NMT1 P30419 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
SCHEMBL3317486 1.00 SSTR4 (0.35) SSTR4SSTR1NCF1NMT1
SCHEMBL3319047 1.00 SSTR4 (0.35) SSTR4SSTR1NCF1NMT1
SCHEMBL3319454 1.00 SSTR4 (0.35) SSTR4SSTR1NCF1NMT1
SCHEMBL3316161 1.00 SSTR4 (0.35) SSTR4SSTR1NCF1NMT1
Hydrochloric Acid SCHEMBL5276774 0.98 SSTR4 (0.34) SSTR4SSTR1NCF1NMT1
SCHEMBL27312835 0.83 NCF1 (0.32) NCF1
SCHEMBL25103907 0.79
SCHEMBL23690733 0.79
SCHEMBL23691093 0.79
SCHEMBL23690731 0.79

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021262596-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2021-12-30 WO disclosed
US-20100104659-A1 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2010-04-29 US disclosed
EP-2041141-A2 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2009-04-01 EP disclosed
EP-1664026-B1 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2009-01-21 EP disclosed
US-7465746-B2 Fluorinated 2,4-diaryl-2,5-dihydropyrrole inhibitors of the mitotic kinesin KSP MERCK & CO., INC. (US) 2008-12-16 US disclosed
US-7465746-B2 Fluorinated 2,4-diaryl-2,5-dihydropyrrole inhibitors of the mitotic kinesin KSP MERCK & CO., INC. (US) 2008-12-16 US disclosed
US-20080207693-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-08-28 US disclosed
WO-2008006883-A2 BENZOPYRANOPYRAZOLES 4SC AG (DE) 2008-01-17 WO 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-20080207693-A1 Mitotic Kinesin Inhibitors KIF5B, KIF2C, KIF23 SSTR4 4817/4885SSTR1 4775/4885NCF1 2345/4885
US-20100104659-A1 BENZOPYRANOPYRAZOLES BAX, BCL2, BAD SSTR4 3627/4885SSTR1 3674/4885NCF1 720/4885

“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.