SCHEMBL10940906

SCHEMBL10940906

CCC[CH]OCC(OCC)OCC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.33
LMNA P02545 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL2152975 0.75
SCHEMBL17438637 0.74 THRB (0.32) THRBLMNA
SCHEMBL60185 0.73
SCHEMBL128031 0.73
SCHEMBL17048893 0.73 ALDH1A1 (0.33) ALDH1A1
SCHEMBL16115518 0.73 THRB (0.31) THRB
SCHEMBL17048883 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL6434384 0.71
SCHEMBL17048887 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1815557 0.70 THRB (0.36) THRBLMNA

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-0051818-B1 PROCESS FOR THE PRODUCTION OF DISCHARGE-RESIST PRINTS ON TEXTILE MATERIALS CASSELLA Aktiengesellschaft (DE) 1985-09-04 EP disclosed
US-4398913-A ALKALINE PASTES CASSELLA AKTIENGESELLSCHAFT (DE) 1983-08-16 US disclosed
EP-0051818-A1 Process for the production of discharge-resist prints on textile materials CASSELLA Aktiengesellschaft (DE) 1982-05-19 EP disclosed