SCHEMBL29026508

SCHEMBL29026508

CC(C)(C)c1ccccc1Sc1ccc(SS)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 0.39
HTR3A P46098 6/20 0.39
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SLC6A4 P31645 4/20 0.33
SLC6A2 P23975 3/20 0.33
CYP1A2 P05177 3/20 0.33
CYP3A4 P08684 3/20 0.33
CYP2D6 P10635 3/20 0.33
CYP2C9 P11712 3/20 0.33
SLC6A3 Q01959 2/20 0.33
DHFR P00374 1/20 0.33
CA2 P00918 1/20 0.33
P2RY2 P41231 1/20 0.33
P2RY1 P47900 1/20 0.33
P2RY14 Q15391 1/20 0.33
RBP4 P02753 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KIF11 P52732 1/20 0.33

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
SCHEMBL7926405 0.84 ALDH1A1 (0.41) HTR1AHTR3AALDH1A1TSHRTDP1
SCHEMBL28818579 0.81 MMP2 (0.39) HTR1AHTR3AALDH1A1TSHRTDP1
SCHEMBL13216633 0.81 SLC6A4 (0.50) HTR1AHTR3AALDH1A1SLC6A4CYP1A2
SCHEMBL24179692 0.80 TDP1 (0.44) ALDH1A1TSHRTDP1CA2P2RY2
SCHEMBL6364715 0.80 TDP1 (0.48) HTR1AHTR3AALDH1A1TSHRTDP1
SCHEMBL28818585 0.75 ALDH1A1 (0.45) ALDH1A1TDP1SMN1; SMN2
SCHEMBL2026425 0.73 P2RY2 (0.48) ALDH1A1TSHRTDP1CYP3A4CA2
SCHEMBL943247 0.71 TDP1 (0.48) ALDH1A1TSHRTDP1CYP1A2CYP2D6
SCHEMBL31409441 0.70 MAPT (0.40) HTR1AHTR3AALDH1A1TSHRTDP1
SCHEMBL5886112 0.70 MAPT (0.40) ALDH1A1TDP1CA2P2RY2P2RY1

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-117586478-A Curable composition, cured product thereof, and wafer level lens 株式会社大赛璐 2024-02-23 CN disclosed
CN-116194508-A Sealant, cured body, organic electroluminescent display device, and method for manufacturing organic electroluminescent display device 电化株式会社 2023-05-30 CN disclosed