SCHEMBL3600336

SCHEMBL3600336

CCc1nc(NC(=N)N)sc1-c1ccc(N)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.37
AOC3 Q16853 2/20 0.36
PIK3CD O00329 3/20 0.34
PIK3CA P42336 3/20 0.34
PIK3CB P42338 3/20 0.34
PIK3CG P48736 3/20 0.34
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 4/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
P2RY1 P47900 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
XIAP P98170 4/20 0.32
CLK1 P49759 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL10664409 0.86 PDE3B (0.40) CYP2D6AOC3KDM4EALDH1A1MAPT
SCHEMBL3604664 0.85 TRPM8 (0.37) KDM4EALDH1A1GAAMAPTP2RY1
SCHEMBL8226994 0.85 AOC3 (0.42) AOC3PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL3602221 0.83 MAPT (0.46) ALDH1A1MAPTLMNACYP2C9CYP2C19
SCHEMBL3608584 0.82 PIK3CG (0.51) CYP2D6PIK3CDPIK3CAPIK3CBPIK3CG
Hydrochloric Acid SCHEMBL7142142 0.81 PIK3CD (0.50) CYP2D6PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL3952847 0.79 XIAP (0.39) CYP2D6AOC3PIK3CAKDM4EALDH1A1
SCHEMBL3606458 0.75 TRPM8 (0.36) AOC3KDM4EALDH1A1GAAMAPT
SCHEMBL3601933 0.74 MAOA (0.44) ALDH1A1GAAMAPTLMNARAB9A
SCHEMBL2538900 0.74 ALDH1A1 (0.48) ALDH1A1GAAMAPTP2RY1LMNA

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 7 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 disclosed
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US disclosed
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
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 CYP2D6 4651/4885AOC3 2043/4885PIK3CD 3802/4885

“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.