SCHEMBL9329946

SCHEMBL9329946

O=C(/C=C/c1ccsc1)/C=C/c1ccsc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GUSB P08236 1/20 0.54
TAS1R3 Q7RTX0 2/20 0.51
TAS1R1 Q7RTX1 2/20 0.51
CYP1A2 P05177 3/20 0.50
CYP2D6 P10635 2/20 0.50
CYP2C9 P11712 2/20 0.50
F3 P13726 2/20 0.50
PLIN1 O60240 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
RECQL P46063 1/20 0.50
PLIN5 Q00G26 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ABHD5 Q8WTS1 1/20 0.50
ALOX5 P09917 3/20 0.49
HSD11B1 P28845 2/20 0.48
TYR P14679 1/20 0.48
JUN P05412 1/20 0.47
NFKB1 P19838 1/20 0.47

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
SCHEMBL9329953 1.00 GUSB (0.54) GUSBTAS1R3TAS1R1CYP1A2CYP2D6
SCHEMBL1126747 0.85 HCAR2 (0.54) GUSBTAS1R3TAS1R1CYP2C9ALDH1A1
SCHEMBL12924107 0.85 HCAR2 (0.54) GUSBTAS1R3TAS1R1CYP2C9ALDH1A1
SCHEMBL1126746 0.85 HCAR2 (0.54) GUSBTAS1R3TAS1R1CYP2C9ALDH1A1
SCHEMBL9256644 0.83 GLA (0.53) GUSBTAS1R3TAS1R1LMNAMAPT
SCHEMBL6836849 0.83 GUSB (0.51) GUSBTAS1R3TAS1R1MAPTALOX5
SCHEMBL1384049 0.83 ALOX5 (0.54) GUSBTAS1R3TAS1R1ALOX5JAK2
SCHEMBL6836844 0.83 GUSB (0.51) GUSBTAS1R3TAS1R1MAPTALOX5
SCHEMBL1478122 0.83 ALOX5 (0.54) GUSBTAS1R3TAS1R1ALOX5JAK2
SCHEMBL9256654 0.83 GLA (0.53) GUSBTAS1R3TAS1R1LMNAMAPT

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
US-5352802-A Derivatives of 4H-thiopyran-1,1-dioxide EASTMAN KODAK COMPANY (US) 1994-10-04 US disclosed
US-5300385-A Low voltage, high speed EASTMAN KODAK COMPANY (US) 1994-04-05 US disclosed