SCHEMBL9494147

SCHEMBL9494147

CCCCSCC(C)OC(=O)c1cc(N=c2sc(=O)n3n2CCCC3)c(F)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9494145 1.00 HPGD (0.33) HPGDCYP1A2CYP2C19LMNAMAPT
SCHEMBL9492294 0.96 HPGD (0.35) HPGDCYP1A2CYP2C19LMNAMAPT
SCHEMBL9492292 0.96 HPGD (0.35) HPGDCYP1A2CYP2C19LMNAMAPT
SCHEMBL9492161 0.92 HPGD (0.37) HPGDLMNAMAPTSMN1; SMN2
SCHEMBL9492159 0.92 HPGD (0.37) HPGDLMNAMAPTSMN1; SMN2
SCHEMBL9422452 0.89 HPGD (0.37) HPGDLMNAMAPTSMN1; SMN2
SCHEMBL9493042 0.89 HPGD (0.37) HPGDLMNAMAPTSMN1; SMN2
SCHEMBL9493857 0.88 HPGD (0.36) HPGDLMNAMAPTSMN1; SMN2
SCHEMBL9493861 0.88 HPGD (0.36) HPGDLMNAMAPTSMN1; SMN2
SCHEMBL9491324 0.84 HPGD (0.39) HPGDLMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0457714-A1 Thiadiazabicyclononane derivatives, process for their preparation, intermediates and their use as herbicides CIBA-GEIGY AG (CH) 1991-11-21 EP claimed
US-5229514-A Thiourea compounds containing pyridazine ring CIBA-GEIGY CORPORATION (US) 1993-07-20 US disclosed
US-5135562-A 8-thia-1,6-diazabicyclo[4.3.0]nonane herbicides CIBA-GEIGY CORPORATION (US) 1992-08-04 US disclosed
EP-0457714-A1 Thiadiazabicyclononane derivatives, process for their preparation, intermediates and their use as herbicides CIBA-GEIGY AG (CH) 1991-11-21 EP disclosed