SCHEMBL11069638

SCHEMBL11069638

CCCCCCCCOP(OCC)OCCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35
USP2 O75604 1/20 0.35
CA1 P00915 8/20 0.34
CA2 P00918 8/20 0.34
CA9 Q16790 7/20 0.34
LPAR3 Q9UBY5 6/20 0.34
LPAR2 Q9HBW0 5/20 0.34
CA12 O43570 3/20 0.34
CA7 P43166 3/20 0.34
CA14 Q9ULX7 3/20 0.34
LPAR1 Q92633 2/20 0.34
CA3 P07451 2/20 0.34
CA4 P22748 2/20 0.34
CA6 P23280 2/20 0.34
CA5A P35218 2/20 0.34

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
SCHEMBL11574391 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL22729145 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL1725382 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL11432203 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL1725733 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL1726586 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL1024728 0.95 THRB (0.40) THRBTSHRMEN1HTTKMT2A
SCHEMBL1725304 0.93 THRB (0.35) THRBTSHRMEN1HTTKMT2A
SCHEMBL100286 0.88 THRB (0.47) THRBTSHRMEN1HTTKMT2A
SCHEMBL10390885 0.88 THRB (0.47) THRBTSHRMEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4446061-A FIREPROOFING, SMOKELESS, PHOSPHITE/PHOSPHONATE MONSANTO COMPANY (US) 1984-05-01 US disclosed
US-4313761-A FIREPROOFING AND SMOKE SUPPRESSANTS MONSANTO COMPANY (US) 1982-02-02 US disclosed
US-4260542-A FLAME RETARDANTS, SMOKE SUPPRESSANTS MONSANTO COMPANY (US) 1981-04-07 US disclosed
US-4206133-A FLAME RETARDANTS AND SMOKE SUPPRESSANTS MONSANTO COMPANY (US) 1980-06-03 US disclosed
US-4133823-A FIREPROOFING, SMOKELESS MONSANTO COMPANY (US) 1979-01-09 US disclosed