SCHEMBL6232031

SCHEMBL6232031

OCCON(CCN(OCCO)OCCO)OCCO

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
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
SCHEMBL4130583 0.90 TSHR (0.37) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL4614745 0.87 MAPT (0.46) TSHRMAPK1ALDH1A1
SCHEMBL11640522 0.85 TSHR (0.33) TSHRMAPK1MEN1KMT2A
SCHEMBL3417964 0.83 TSHR (0.53) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL1038170 0.83 TSHR (0.35) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL346950 0.83 TSHR (0.32) TSHRMAPK1MEN1KMT2A
SCHEMBL11775337 0.83 TSHR (0.32) TSHRMAPK1MEN1KMT2A
SCHEMBL97472 0.83 TSHR (0.39) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL11778104 0.81 LMNA (0.32) TSHRMAPK1MEN1KMT2AALDH1A1
Ammonia Solution, Strong SCHEMBL8059836 0.81 TSHR (0.37) TSHRMAPK1MEN1KMT2AALDH1A1

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-0974568-B1 Process for the encapsulation of fertilizers with a symmetrical polyureaurethane composition BAYER AG (US) 2005-04-20 EP disclosed
US-6165550-A Symmetrical Polyurea-urethane fertilizer encapsulation BAYER CORPORATION (US) 2000-12-26 US disclosed
EP-0974568-A2 Symmetrical polyureaurethane fertilizer encapsulation Bayer Corporation (US) 2000-01-26 EP disclosed