SCHEMBL11699369

SCHEMBL11699369

Fc1ccc(CSC(Cn2ccnc2)c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 11/20 0.87
CYP2C9 P11712 9/20 0.87
CYP3A4 P08684 8/20 0.87
CYP1A2 P05177 6/20 0.87
CYP2D6 P10635 6/20 0.87
CYP2C19 P33261 6/20 0.87
NR1I2 O75469 4/20 0.87
ADORA3 P0DMS8 4/20 0.87
ADRA2B P18089 4/20 0.87
CHRM3 P20309 4/20 0.87
SLC6A2 P23975 4/20 0.87
SLC6A4 P31645 4/20 0.87
DRD3 P35462 4/20 0.87
OPRK1 P41145 4/20 0.87
KCNH2 Q12809 4/20 0.87
TDP1 Q9NUW8 3/20 0.87
ADRA2C P18825 3/20 0.87
ALOX15 P16050 3/20 0.87
NR3C1 P04150 3/20 0.87
FYN P06241 3/20 0.87

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
Sulconazole SCHEMBL7600685 0.93 IDO1 (1.00) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
Sulconazole SCHEMBL22123404 0.93 IDO1 (1.00) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
Sulconazole SCHEMBL34762 0.93 IDO1 (1.00) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
Sulconazole SCHEMBL7600689 0.93 IDO1 (1.00) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
Sulconazole SCHEMBL34761 0.93 IDO1 (1.00) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
Sulconazole SCHEMBL29923838 0.93 IDO1 (1.00) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
Sulconazole SCHEMBL28462757 0.92 IDO1 (0.98) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
Sulconazole SCHEMBL29194304 0.92 IDO1 (0.98) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
SCHEMBL11632167 0.89 IDO1 (0.70) IDO1CYP2C9CYP3A4CYP1A2CYP2D6
SCHEMBL11698496 0.89 IDO1 (0.87) IDO1CYP2C9CYP3A4CYP1A2CYP2D6

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-4055652-A 1-[β(R-thio)phenethyl]imidazoles and derivatives thereof SYNTEX (U.S.A.) INC. (US) 1977-10-25 US claimed
US-4055652-A 1-[β(R-thio)phenethyl]imidazoles and derivatives thereof SYNTEX (U.S.A.) INC. (US) 1977-10-25 US disclosed