SCHEMBL3609767

SCHEMBL3609767

CNC(=O)c1cccc(-c2csc(NC(=N)N)n2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.55
MAPT P10636 5/20 0.54
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
GAA P10253 2/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ABL1 P00519 2/20 0.53
ALDH1A1 P00352 4/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
THRB P10828 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
RRM1 P23921 2/20 0.50
RRM2B Q7LG56 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL11091588 0.89 MAPT (0.55) MAPTRAB9ANPC1GAANPSR1
SCHEMBL11085002 0.88 ABL1 (0.49) MAPTRAB9ANPC1GAANPSR1
SCHEMBL3603750 0.88 MAPT (0.55) MAPTRAB9ANPC1GAANPSR1
SCHEMBL3606683 0.86 CSNK2A1 (0.58) PHGDHMAPTRAB9ANPC1GAA
SCHEMBL10743494 0.86 PHGDH (0.53) PHGDHMAPTRAB9ANPC1GAA
SCHEMBL10743499 0.86 PHGDH (0.53) PHGDHMAPTRAB9ANPC1GAA
SCHEMBL11087776 0.86 ALDH1A1 (0.56) MAPTRAB9ANPC1GAANPSR1
Bromide SCHEMBL7142457 0.85 CSNK2A1 (0.57) PHGDHMAPTRAB9ANPC1GAA
SCHEMBL11090239 0.85 MAPT (0.51) MAPTRAB9ANPC1GAANPSR1
SCHEMBL11248461 0.84 MAPT (0.55) MAPTRAB9ANPC1GAANPSR1

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
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US claimed
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US disclosed
US-4696933-A INHIBIT GASTRIC ACID SECRETION ICI AMERICAS INC. (GB) 1987-09-29 US disclosed
US-4496564-A HISTAMINE H-2 ANTIGONISTS ICI AMERICAS INC. (US) 1985-01-29 US disclosed
EP-0060093-A2 Amide derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-09-15 EP 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 PHGDH 1989/4885MAPT 2/4885RAB9A 1024/4885

“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.