SCHEMBL7529938

SCHEMBL7529938

CC(CN)NC(C)(C)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
PIK3CD O00329 1/20 0.31

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
SCHEMBL24092090 0.78
SCHEMBL988445 0.78
SCHEMBL24092097 0.78
SCHEMBL3162137 0.76 ALDH1A1 (0.33) ALDH1A1PIK3CD
SCHEMBL24259885 0.76 ALDH1A1 (0.33) ALDH1A1PIK3CD
SCHEMBL24847190 0.69
SCHEMBL22511790 0.69 PIK3CD (0.30) PIK3CD
SCHEMBL104118 0.67 PIK3CD (0.32) PIK3CD
Hydrochloric Acid SCHEMBL3162809 0.65 GAA (0.33) PIK3CD
SCHEMBL2020040 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180086873-A1 Ethoxylated Vegetable Oils in Low Density Spray Foam Formulations STEPAN COMPANY 2018-03-29 US disclosed
EP-1192198-A1 PROCESS FOR MAKING GRAFT POLYOLS USING T-AMYL PEROXY FREE RADICAL INITIATOR BASF CORPORATION (US) 2002-04-03 EP disclosed
WO-2000059971-A1 PROCESS FOR MAKING GRAFT POLYOLS USING T-AMYL PEROXY FREE RADICAL INITIATOR BASF CORPORATION (DE) 2000-10-12 WO disclosed
US-5124369-A Using a noncrossed-linked, water-soluble polyacrylate salt as catalyst and water as blowing agent SHELL OIL COMPANY (US) 1992-06-23 US disclosed