SCHEMBL3603474

SCHEMBL3603474

CC(C)C(=O)N1CCc2cc(-c3csc(NC(=N)N)n3)ccc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.71
MAPT P10636 10/20 0.71
NPC1 O15118 9/20 0.71
ALDH1A1 P00352 9/20 0.71
SMN1; SMN2 Q16637 8/20 0.71
USP2 O75604 1/20 0.71
HPGD P15428 1/20 0.71
ALOX15 P16050 1/20 0.71
HSD17B10 Q99714 1/20 0.71
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
TP53 P04637 1/20 0.59
GFER P55789 1/20 0.59
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
KLK7 P49862 1/20 0.53
CYP3A4 P08684 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52

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
SCHEMBL3609848 0.89 RAB9A (0.59) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL3602577 0.86 KLK7 (0.69) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL3607158 0.85 RAB9A (0.75) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL17549356 0.82 KLK7 (0.79) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL3607915 0.82 SMN1; SMN2 (0.57) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL3604832 0.80 MAPT (0.78) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL3610538 0.77 ALDH1A1 (0.54) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL27768178 0.76 MAPT (0.48) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL17549361 0.75 KLK7 (0.73) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2
SCHEMBL17549357 0.73 KLK7 (0.57) RAB9AMAPTNPC1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US claimed
CN-101466692-A Thiazol-guanidine derivatives useful as a (beta) - related pathologies ASTRAZENECA AB (SE) 2009-06-24 CN claimed
EP-2010508-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES AstraZeneca AB (SE) 2009-01-07 EP claimed
WO-2007120096-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES ASTRAZENECA AB (SE) 2007-10-25 WO claimed
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US disclosed
CN-101466692-A Thiazol-guanidine derivatives useful as a (beta) - related pathologies ASTRAZENECA AB (SE) 2009-06-24 CN disclosed
EP-2010508-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES AstraZeneca AB (SE) 2009-01-07 EP disclosed
WO-2007120096-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES ASTRAZENECA AB (SE) 2007-10-25 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 (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-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies GRN, MAPT, GUCY1B1 RAB9A 1024/4885MAPT 2/4885NPC1 267/4885

“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.