SCHEMBL8648085

SCHEMBL8648085

CCC(C)P(C(C)CC)C(C)CC.CCC(C)P(C(C)CC)C(C)CC.CCC(C)P(C(C)CC)C(C)CC.CCC(C)P(C(C)CC)C(C)CC.[Ru]

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL1240631 0.96 TSHR (0.38) TSHR
Hydrochloric Acid SCHEMBL28599167 0.92 TSHR (0.35) TSHR
Bromide SCHEMBL28610966 0.92 TSHR (0.35) TSHR
Iodide SCHEMBL28603989 0.92 TSHR (0.35) TSHR
Carbon Monoxide SCHEMBL8652260 0.90 TSHR (0.30) TSHR
Carbon Monoxide SCHEMBL8649609 0.90 TSHR (0.30) TSHR
SCHEMBL8652367 0.86 TSHR (0.32) TSHR
SCHEMBL8648547 0.83 TSHR (0.30) TSHR
SCHEMBL10905095 0.81 TSHR (0.33) TSHR
SCHEMBL10903894 0.81 TSHR (0.33) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516982-B1 Process for producing a heterocyclic tertiary amine NISSAN CHEMICAL IND LTD (JP) 1998-09-16 EP disclosed
US-5283341-A Catalytic alkylation NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1994-02-01 US disclosed
EP-0516982-A1 Process for producing a heterocyclic tertiary amine NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1992-12-09 EP disclosed