SCHEMBL28449495

SCHEMBL28449495

C=CCSC=C.C=CSC

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 2/20 0.40
HPGD P15428 2/20 0.40
ALOX15 P16050 1/20 0.40
ALOX5 P09917 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL2838456 0.87
SCHEMBL14972679 0.74 TRPA1 (0.53) TRPA1ALDH1A1CYP3A4HPGDALOX15
SCHEMBL383725 0.73
SCHEMBL4446062 0.69
SCHEMBL345847 0.69
SCHEMBL6660314 0.67
SCHEMBL9042 0.67
Hydrogen Sulfide SCHEMBL5265826 0.65
Hydrogen Sulfide SCHEMBL5265823 0.65 TRPA1 (0.47) TRPA1ALDH1A1CYP3A4HPGDALOX15
Water SCHEMBL27825407 0.65 TRPA1 (0.47) TRPA1ALDH1A1CYP3A4HPGDALOX15

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
CN-112154168-A Process for preparing temperature-stable polyalkenamers 赢创运营有限公司 2020-12-29 CN claimed
CN-111491716-A Method for producing thermally stable ring-opened polycycloolefins 赢创运营有限公司 2020-08-04 CN claimed
CN-111491716-A Method for producing thermally stable ring-opened polycycloolefins 赢创运营有限公司 2020-08-04 CN disclosed