SCHEMBL9380424

SCHEMBL9380424

CON=C1CCN(C(=N)N)CC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.40
TMPRSS2 O15393 2/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAOA P21397 1/20 0.37
SLC6A2 P23975 1/20 0.37
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
TSHR P16473 1/20 0.33
PMP22 Q01453 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CHIA Q9BZP6 1/20 0.33

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
SCHEMBL9059614 1.00 F2 (0.40) F2TMPRSS2HTR1AADRA2ACYP2D6
SCHEMBL9385821 0.75 F2 (0.46) F2TMPRSS2HTR1AADRA2ACYP2D6
SCHEMBL9059632 0.75 F2 (0.46) F2TMPRSS2HTR1AADRA2ACYP2D6
Hydrochloric Acid SCHEMBL9835312 0.75
Hydrochloric Acid SCHEMBL9836382 0.75
SCHEMBL12756975 0.74 TDP1 (0.40)
SCHEMBL9042983 0.70 RAB9A (0.42) MAOA
SCHEMBL14155722 0.69 CYP2D6 (0.42) CYP2D6LMNATSHRPMP22HSD17B10
Hydrochloric Acid SCHEMBL9835123 0.69
Hydrochloric Acid SCHEMBL9833802 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0536151-B1 ORTHOSUBSTITUTED BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM BOOTS CO PLC (GB) 1994-09-14 EP claimed