SCHEMBL10705758

SCHEMBL10705758

C=C(C)C.C=CC=C(C)C

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
TP53 P04637 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
SCHEMBL22994 0.93
SCHEMBL5553167 0.89
Ethylene SCHEMBL1685604 0.89
SCHEMBL9100510 0.89
SCHEMBL11311289 0.89
Butadiene SCHEMBL11317805 0.89 ALDH1A1 (0.35) ALDH1A1TSHRTP53
SCHEMBL11325636 0.87 ALDH1A1 (0.62) ALDH1A1TSHRTP53
Formaldehyde SCHEMBL16909961 0.83 ALDH1A1 (0.37) ALDH1A1TSHRTP53
Bicarbonate SCHEMBL29245730 0.80 ALDH1A1 (0.42) ALDH1A1TSHRTP53
SCHEMBL28187043 0.78

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
CN-1047424-C Leadfree roof flashing material RASMUSSEN & CO V K (DK) 1999-12-15 CN claimed
EP-0111391-B1 POLYMER MOLECULAR WEIGHT REDUCTION PROCESS POLYSAR LIMITED (CA) 1988-03-02 EP claimed
EP-0111391-A2 Polymer molecular weight reduction process POLYSAR LIMITED (CA) 1984-06-20 EP claimed
EP-0111391-B1 POLYMER MOLECULAR WEIGHT REDUCTION PROCESS POLYSAR LIMITED (CA) 1988-03-02 EP disclosed
EP-0111391-A2 Polymer molecular weight reduction process POLYSAR LIMITED (CA) 1984-06-20 EP disclosed