SCHEMBL28136830

SCHEMBL28136830

C=C=C.C=CCC.C=CCCCC

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.74
ALDH1A1 P00352 3/20 0.74
TRPA1 O75762 3/20 0.34
LMNA P02545 2/20 0.30
ABCC4 O15439 1/20 0.30
MAPT P10636 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
SCHEMBL27976368 0.95
SCHEMBL7542861 0.92 TSHR (0.88) TSHRALDH1A1TRPA1LMNAABCC4
SCHEMBL19953488 0.92 TSHR (0.88) TSHRALDH1A1TRPA1LMNAABCC4
SCHEMBL4670048 0.92 TSHR (0.88) TSHRALDH1A1TRPA1LMNAABCC4
SCHEMBL7920542 0.92 TSHR (0.88) TSHRALDH1A1TRPA1LMNAABCC4
Ethylene SCHEMBL1798369 0.89 TSHR (0.82) TSHRALDH1A1TRPA1LMNAABCC4
SCHEMBL8943864 0.89 TSHR (0.93) TSHRALDH1A1TRPA1LMNAABCC4
Propene SCHEMBL3798108 0.86 TSHR (0.78) TSHRALDH1A1TRPA1LMNAABCC4
SCHEMBL5606382 0.86 TSHR (1.00) TSHRALDH1A1TRPA1LMNAABCC4
SCHEMBL2405672 0.86 TSHR (1.00) TSHRALDH1A1TRPA1LMNAABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106661159-B Ethylene -1- hexene -1- butene terpolymers and the film comprising the terpolymer LG化学株式会社 2019-08-27 CN disclosed
CN-106661159-A Ethylene-1-hexene-1-butene terpolymer and film comprising same LG化学株式会社 2017-05-10 CN disclosed