SCHEMBL30705332

SCHEMBL30705332

CC(=CCCC=C(C)c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.44
TBXAS1 P24557 2/20 0.44
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 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
SCHEMBL10454486 0.89 TBXAS1 (0.42) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL10454475 0.89 TBXAS1 (0.42) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL1193728 0.89 CYP1A2 (0.42) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL9757698 0.89 CYP1A2 (0.42) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL29633520 0.89 TBXAS1 (0.41) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL10907609 0.89 CYP1A2 (0.42) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL13479915 0.87 TBXAS1 (0.40) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL28077326 0.87 TBXAS1 (0.43) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL10991192 0.87 TBXAS1 (0.40) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2
SCHEMBL10991197 0.87 TBXAS1 (0.40) KDM1ATBXAS1MTNR1AMTNR1BCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117363233-A Hot melt adhesive film for lithium battery packaging 江苏惠沣环保科技有限公司 2024-01-09 CN disclosed