SCHEMBL9628823

SCHEMBL9628823

NC(c1ccccc1)n1c(=S)sc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.39
SLC6A2 P23975 1/20 0.39
HSD17B10 Q99714 2/20 0.38
F12 P00748 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.35
HPGD P15428 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
DPP4 P27487 2/20 0.33
CHEK1 O14757 1/20 0.33
PDGFRA P16234 1/20 0.33
CDK5 Q00535 1/20 0.33
DYRK1A Q13627 1/20 0.33

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
SCHEMBL9628810 0.79 HTR2A (0.47) SLC6A4SLC6A2HSD17B10ALDH1A1KDM4E
SCHEMBL11783847 0.75 ALDH1A1 (0.44) SLC6A4SLC6A2HSD17B10F12ALDH1A1
SCHEMBL11082450 0.71 ALDH1A1 (0.42) SLC6A4SLC6A2HSD17B10F12ALDH1A1
SCHEMBL28639501 0.69 DPP4 (0.42) CYP1A2KDM4EL3MBTL1ATMDPP4
SCHEMBL11780045 0.66 L3MBTL1 (0.65) HSD17B10ALDH1A1CYP1A2HPGDKDM4E
SCHEMBL13657451 0.65 ALDH1A1 (0.40) SLC6A4HSD17B10F12ALDH1A1CYP1A2
SCHEMBL230331 0.65 F12 (0.59) F12ALDH1A1CYP1A2KDM4EL3MBTL1
SCHEMBL9628571 0.64 HSD17B10 (0.39) SLC6A4HSD17B10F12ALDH1A1CYP1A2
SCHEMBL19514739 0.63 ALDH1A1 (0.47) HSD17B10F12ALDH1A1CYP1A2HPGD
SCHEMBL4616539 0.63 SLC6A2 (0.51) SLC6A4SLC6A2F12ALDH1A1CYP1A2

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