SCHEMBL3586850

SCHEMBL3586850

CCOC(=O)c1csc(NC(=O)c2cccs2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 1.00
NPC1 O15118 10/20 1.00
TDP1 Q9NUW8 1/20 1.00
SMN1; SMN2 Q16637 9/20 0.70
NPSR1 Q6W5P4 3/20 0.68
HPGD P15428 6/20 0.66
CYP1A2 P05177 1/20 0.63
CYP2C19 P33261 1/20 0.63
HSP90AA1 P07900 3/20 0.63
MAPK1 P28482 2/20 0.63
MAPT P10636 1/20 0.63
KDM4E B2RXH2 5/20 0.60
ALDH1A1 P00352 3/20 0.60
LMNA P02545 6/20 0.59
HSD17B10 Q99714 3/20 0.59
TP53 P04637 1/20 0.59
NFKB1 P19838 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
TSHR P16473 3/20 0.58

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
SCHEMBL3594194 0.82 RAB9A (1.00) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL13879764 0.80 CYP1A2 (0.69) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL289683 0.80 SMN1; SMN2 (1.00) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL4871149 0.79 CYP1A2 (0.76) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL3602966 0.79 RAB9A (0.71) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL3600963 0.79 RAB9A (0.71) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL3601123 0.79 RAB9A (0.69) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL3608921 0.78 SMN1; SMN2 (0.78) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL3594123 0.78 SMN1; SMN2 (0.78) RAB9ANPC1TDP1SMN1; SMN2NPSR1
SCHEMBL6799592 0.78 RAB9A (0.77) RAB9ANPC1TDP1SMN1; SMN2NPSR1

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
US-7799738-B2 Insecticidal 2-acylaminothiazole-4-carboxamides BAYER CROPSCIENCE AG (DE) 2010-09-21 US disclosed
US-20080300136-A1 Insecticidal 2-Acylaminothiazole-4-Carboxamides BAYER CROPSCIENCE AG (DE) 2008-12-04 US disclosed
EP-1963290-A1 INSECTICIDAL 2 -ACYLAMINOTHIAZOLE-4 -CARBOXAMIDES Bayer CropScience Aktiengesellschaft (DE) 2008-09-03 EP disclosed
WO-2007051560-A1 INSECTICIDAL 2 -ACYLAMINOTHIAZOLE-4 -CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2007-05-10 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 (1 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-20080300136-A1 Insecticidal 2-Acylaminothiazole-4-Carboxamides AADAC, HDHD5, HRH4 RAB9A 2239/4885NPC1 2323/4885TDP1 4465/4885

“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.