SCHEMBL11436620

SCHEMBL11436620

CCOCN(COCC)C(=O)N(COCC)COCC.COCN(COC)C(=O)N(COC)COC

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
TP53 P04637 1/20 0.32
LMNA P02545 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
SCHEMBL12420092 0.92
SCHEMBL10228703 0.91 ALDH1A1 (0.37) ALDH1A1TSHRTP53LMNA
SCHEMBL12420087 0.90 ALDH1A1 (0.30) ALDH1A1
SCHEMBL197051 0.85 TSHR (0.32) ALDH1A1TSHR
SCHEMBL9972955 0.84 LMNA (0.41) ALDH1A1TSHRLMNA
SCHEMBL11316780 0.81 LMNA (0.37) ALDH1A1TP53LMNA
SCHEMBL19959611 0.81 LMNA (0.41) ALDH1A1TP53LMNA
SCHEMBL15800861 0.78 LMNA (0.39) ALDH1A1TP53LMNA
SCHEMBL2122710 0.78 THRB (0.39) ALDH1A1TSHR
SCHEMBL8395075 0.78 ZDHHC20 (0.39) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4209581-A UREA OR THIOUREA RESIN WITH N-ALKYLOL ACRYLAMIDE TOKYO OHKA KOGYO KABUSHIKI KAISHA (JP) 1980-06-24 US disclosed