SCHEMBL9215221

SCHEMBL9215221

Fc1ccc2c(c1)CC(CI)CS2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.36
SLC6A4 P31645 2/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
DRD2 P14416 2/20 0.32
DRD3 P35462 2/20 0.32
HTR1A P08908 1/20 0.32
HTR2A P28223 1/20 0.32
HTR7 P34969 1/20 0.32
HTR2B P41595 1/20 0.32
DRD1 P21728 1/20 0.31
AURKA O14965 1/20 0.31
CHEK2 O96017 1/20 0.31
CDK1 P06493 1/20 0.31
PIM1 P11309 1/20 0.31
FGFR1 P11362 1/20 0.31
CDK2 P24941 1/20 0.31
MARK3 P27448 1/20 0.31
CSNK2A1 P68400 1/20 0.31

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
SCHEMBL9209494 0.84 MALT1 (0.38) MALT1SLC6A4ADRA2AADRA2BADRA2C
SCHEMBL9217505 0.81 PNMT (0.33) ADRA2AADRA2BADRA2C
SCHEMBL9220601 0.80 MALT1 (0.39) MALT1SLC6A4ADRA2AADRA2BADRA2C
SCHEMBL9210918 0.79 MALT1 (0.43) MALT1HTR2B
Hydrochloric Acid SCHEMBL9273659 0.79 HTR2A (0.37) MALT1SLC6A4ADRA2AADRA2BADRA2C
Hydrochloric Acid SCHEMBL9278206 0.78 MALT1 (0.35) MALT1SLC6A4ADRA2AADRA2BADRA2C
Hydrochloric Acid SCHEMBL9274817 0.77 DRD2 (0.38) SLC6A4ADRA2CDRD2DRD3HTR1A
Hydrochloric Acid SCHEMBL9275494 0.76 KDM4E (0.38) SLC6A4ADRA2CDRD2DRD3HTR1A
SCHEMBL9220092 0.75 DRD2 (0.46) SLC6A4DRD2DRD3HTR1AHTR2A
SCHEMBL9869729 0.75 MALT1 (0.38) MALT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0389425-B1 Benzotiopyranyl amines CIBA GEIGY AG (CH) 1995-04-26 EP disclosed
US-5071858-A Antipsychotic benzothiopyranylamines CIBA-GEIGY CORPORATION (US) 1991-12-10 US disclosed
EP-0389425-A1 Benzotiopyranyl amines CIBA-GEIGY AG (CH) 1990-09-26 EP disclosed