SCHEMBL7786352

SCHEMBL7786352

CON(CCCCCCN(OC)C(C)=O)C(C)=O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL27871210 0.91 CES2 (0.39) ALDH1A1
SCHEMBL18665383 0.86 CA1 (0.40) ALDH1A1
SCHEMBL24806089 0.84 TSHR (0.31)
SCHEMBL21473428 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL21482016 0.81
SCHEMBL19161742 0.81 KDM4C (0.35) ALDH1A1
SCHEMBL7058497 0.80
SCHEMBL12534540 0.78 ALDH1A1 (0.34) ALDH1A1
SCHEMBL16125669 0.75 MEN1 (0.30)
SCHEMBL207668 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795543-B1 Use of high boiling solvents or solvent mixtures as heat exchange medium in the thermal decomposition of carbamic esters BAYER AG (DE) 2001-10-31 EP disclosed
EP-0795544-B1 Process for the thermal decomposition of carbamic esters BAYER AG (DE) 2001-10-31 EP disclosed
US-5883291-A Heat exchange media for the thermal cracking of carbamic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1999-03-16 US disclosed
US-5731458-A Process for thermally cracking carbamic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1998-03-24 US disclosed
EP-0795543-A1 Use of high boiling solvents or solvent mixtures as heat exchange medium in the thermal decomposition of carbamic esters BAYER AG (DE) 1997-09-17 EP disclosed
EP-0795544-A1 Process for the thermal decomposition of carbamic esters BAYER AG (DE) 1997-09-17 EP disclosed
EP-0542106-B1 Process for the preparation of polyisocyanates BAYER AG (DE) 1995-12-27 EP disclosed
EP-0396977-B1 Process for the preparation of polyisocyanates BAYER AG (DE) 1994-06-15 EP disclosed
US-5284969-A Thermal decomposition of the corresponding carbamic acid esters BAYER AKTIENGESELLSCHAFT (DE) 1994-02-08 US disclosed
EP-0542106-A2 Process for the preparation of polyisocyanates BAYER AG (DE) 1993-05-19 EP disclosed
US-5043471-A Process for the preparation of polyisocyanates BAYER AKTIENGESELLSCHAFT (DE) 1991-08-27 US disclosed
EP-0396977-A2 Process for the preparation of polyisocyanates BAYER AG (DE) 1990-11-14 EP disclosed
EP-0396976-A2 Process for the preparation of polyisocyanates BAYER AG (DE) 1990-11-14 EP disclosed