SCHEMBL3087197

SCHEMBL3087197

O=Cc1cnc(SCc2ccccc2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 2/20 0.46
HPGD P15428 1/20 0.46
CDK1 P06493 1/20 0.45
CCNB1 P14635 1/20 0.45
MAPT P10636 4/20 0.43
CDK2 P24941 1/20 0.43
HSD17B10 Q99714 1/20 0.42
PKM P14618 3/20 0.42
POLB P06746 1/20 0.42
FFAR1 O14842 1/20 0.42
MAPK1 P28482 1/20 0.42
CA1 P00915 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
ABL1 P00519 1/20 0.40
RIN1 Q13671 1/20 0.40
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL1502786 0.76 HSD17B10 (0.46) ALDH1A1LMNAHPGDCDK1CCNB1
SCHEMBL27174936 0.76 HSD17B10 (0.46) ALDH1A1LMNAHPGDCDK1CCNB1
SCHEMBL11751962 0.75 LMNA (0.56) ALDH1A1KDM4ELMNAHPGDCDK1
SCHEMBL31595934 0.73 ALDH1A1 (0.55) ALDH1A1KDM4ELMNAHPGDMAPT
SCHEMBL3084837 0.73 LMNA (0.43) ALDH1A1KDM4ELMNAHPGDCDK1
SCHEMBL3082339 0.73 LMNA (0.47) ALDH1A1KDM4ELMNAHPGDCDK1
SCHEMBL13143606 0.72 TDP1 (0.38) ALDH1A1KDM4ELMNAMAPTHSD17B10
SCHEMBL3263155 0.70 LMNA (0.72) ALDH1A1KDM4ELMNAHPGDCDK1
SCHEMBL9394 0.69 ALDH1A1 (0.50) ALDH1A1KDM4ELMNAHPGDMAPT
SCHEMBL4169471 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795442-B2 Preparation of thiazoles SYNGENTA CROP PROTECTION, INC. (US) 2010-09-14 US disclosed
US-20090198054-A1 PREPARATION OF THIAZOLES SYNGENTA CROP PROTECTION, INC. (US) 2009-08-06 US disclosed
US-7538229-B2 Preparation of thiazoles SYNGENTA CROP PROTECTION, INC. (US) 2009-05-26 US disclosed
US-20080076920-A1 PREPARATION OF THIAZOLES SYNGENTA CROP PROTECTION, INC. (US) 2008-03-27 US disclosed
US-7323564-B2 Preparation of thiazoles SYNGENTA CROP PROTECTION, INC. (US) 2008-01-29 US disclosed
US-20070055063-A1 PREPARATION OF THIAZOLES SYNGENTA CROP PROTECTION, INC. (US) 2007-03-08 US disclosed
US-7161011-B2 Reactin a thiazole compound with glycidyl aldehyde SYNGENTA CROP PROTECTION, INC. (US) 2007-01-09 US disclosed
EP-1577307-A2 Preparation of thiazoles Syngenta Participations AG (CH) 2005-09-21 EP disclosed
US-20030216579-A1 Preparation of thiazoles PITTERNA THOMAS (CH) 2003-11-20 US disclosed
US-6548676-B1 Halogenation or sulfonylation of 5-methylol-2-sulfanyl-thiazole derivatives; separation, salt formation SYNGENTA CROP PROTECTION, INC. 2003-04-15 US disclosed
EP-0946532-B1 PREPARATION OF THIAZOLES SYNGENTA PARTICIPATIONS AG (CH) 2002-07-17 EP disclosed
EP-1201662-A1 Preparation of thiazoles Syngenta Participations AG (CH) 2002-05-02 EP disclosed
EP-0946532-A1 PREPARATION OF THIAZOLES Novartis AG (CH) 1999-10-06 EP disclosed
WO-1998027075-A1 PREPARATION OF THIAZOLES NOVARTIS AG (CH) 1998-06-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080076920-A1 PREPARATION OF THIAZOLES OXSR1, OSR1, OSBPL3 ALDH1A1 4350/4885KDM4E 4029/4885LMNA 4017/4885
US-20070055063-A1 PREPARATION OF THIAZOLES SLC5A1, TST, TCOF1 ALDH1A1 1685/4885KDM4E 4411/4885LMNA 723/4885
US-20090198054-A1 PREPARATION OF THIAZOLES OXSR1, OSR1, OSBPL3 ALDH1A1 4350/4885KDM4E 4029/4885LMNA 4017/4885
US-20030216579-A1 Preparation of thiazoles CBR1, CBR3, SULT1A1 ALDH1A1 287/4885KDM4E 2788/4885LMNA 1360/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.