SCHEMBL9628979

SCHEMBL9628979

CCCN(CCC)Cn1c(=S)sc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
DRD3 P35462 1/20 0.40
DRD2 P14416 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HTT P42858 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL9627804 0.86 KCNH2 (0.41) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL9629861 0.84 RAB9A (0.40) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL9628803 0.81 ALDH1A1 (0.43) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL9628839 0.80 DRD2 (0.38) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL11782096 0.79 DRD2 (0.48) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL9628230 0.79 L3MBTL1 (0.45) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL513869 0.79 ALDH1A1 (0.48) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL9628527 0.78 ALDH1A1 (0.35) ALDH1A1CYP1A2HPGDHSD17B10DRD2
SCHEMBL9628861 0.77 GAA (0.38) ALDH1A1HPGDHSD17B10HTTKDM4E
SCHEMBL8030664 0.76 DRD2 (0.52) ALDH1A1CYP1A2HPGDHSD17B10DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203033-B1 AMINO ETHYL DERIVATIVE OF BENZOTHIAZOLINTHION AS A LUBRICANT ADDITIVE CIBA-GEIGY AG (CH) 1992-03-11 EP disclosed
US-4810399-A FRICTION, WEAR, CORROSION AND OXIDATION RESISTANCE CIBA-GEIGY CORPORATION (US) 1989-03-07 US disclosed
US-4803001-A RESISTANT TO FRICTION, WEAR, CORROSION AND OXIDATION CIBA-GEIGY CORPORATION (US) 1989-02-07 US disclosed
US-4737302-A Aminomethyl derivatives of benzothiazolinethione as lubricant additives CIBA-GEIGY CORPORATION (US) 1988-04-12 US disclosed
EP-0203033-A2 Amino ethyl derivative of benzothiazolinthion as a lubricant additive CIBA-GEIGY AG (CH) 1986-11-26 EP disclosed