SCHEMBL11399245

SCHEMBL11399245

O=C=NC1[CH]CCC(N=C=O)C1

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL706569 0.76 ALDH1A1 (0.39) ALDH1A1
SCHEMBL44159 0.71 ALDH1A1 (0.57) ALDH1A1
SCHEMBL433014 0.70
SCHEMBL11018120 0.70
SCHEMBL28224018 0.70
SCHEMBL3955252 0.69 ALDH1A1 (0.55) ALDH1A1
SCHEMBL8622614 0.69 ALDH1A1 (0.55) ALDH1A1
SCHEMBL18898123 0.69 ALDH1A1 (0.62) ALDH1A1
SCHEMBL8619404 0.67 ALDH1A1 (0.67) ALDH1A1
SCHEMBL33061 0.67 ALDH1A1 (0.67) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3942356-A1 TEMPLE WITH A METAL INSERT IQ Brand, Design & Production GmbH (AT) 2022-01-26 EP disclosed
EP-3074437-B1 FINISHING AGENT WITH BLOCKED POLYISOCYANATES RUDOLF GMBH (DE) 2018-01-17 EP disclosed
EP-3074437-A1 FINISHING AGENT WITH BLOCKED POLYISOCYANATES Rudolf GmbH (DE) 2016-10-05 EP disclosed
WO-2015078811-A1 FINISHING AGENT WITH BLOCKED POLYISOCYANATES RUDOLF GMBH (DE) 2015-06-04 WO disclosed
CN-101405661-A Substrates coated with branched polyurethanes for electrophotographic printing processes BASF SE (DE) 2009-04-08 CN disclosed
US-4216107-A Organic titanium compounds as viscosity improvers for polyol compounds BASF WYANDOTTE CORPORATION (US) 1980-08-05 US disclosed
US-4107229-A THERMOSETTING POLYMERS, MOLDING MATERIALS, MARINE COATINGS HOOKER CHEMICALS & PLASTICS CORPORATION (US) 1978-08-15 US disclosed