SCHEMBL7426007

SCHEMBL7426007

CC1CNCCN1C(=N)N

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.36
NOS2 P35228 3/20 0.34
HTR6 P50406 1/20 0.31
PLD1 Q13393 1/20 0.30

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
SCHEMBL4804524 1.00 DPP4 (0.36) DPP4NOS2HTR6PLD1
SCHEMBL954795 0.80 DPP4 (0.42) DPP4HTR6PLD1
SCHEMBL954895 0.80 DPP4 (0.42) DPP4HTR6PLD1
SCHEMBL954793 0.80 DPP4 (0.42) DPP4HTR6PLD1
SCHEMBL6504988 0.80 DPP4 (0.36) DPP4HTR6PLD1
Hydrochloric Acid SCHEMBL17560338 0.78 DPP4 (0.41) DPP4PLD1
Hydrochloric Acid SCHEMBL17560337 0.78 DPP4 (0.41) DPP4PLD1
Hydrochloric Acid SCHEMBL538525 0.77 DPP4 (0.31) DPP4NOS2
SCHEMBL2197703 0.76 DPP4 (0.39) DPP4HTR6PLD1
SCHEMBL7108631 0.76 SLC6A1 (0.32) NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1136832-C Wrinkle-improving agent ������������ʽ���� 2004-02-04 CN disclosed
CN-1066719-C Process for preparing compounds having pharmacological activity on the central nervous system WELLCOME FOUND (GB) 2001-06-06 CN disclosed
CN-1066720-C Process for preparing compounds having pharmacological activity on the central nervous system WELLCOME FOUND (GB) 2001-06-06 CN disclosed
CN-1233168-A Wrinkle-improving agent KAO CORP (JP) 1999-10-27 CN disclosed
EP-0719244-A1 PROCESS OF PREPARING 2,3,5-TRIHALOBENZALDEHYDE THE WELLCOME FOUNDATION LIMITED (GB) 1996-07-03 EP disclosed
CN-1119099-A Method for preparing pharmacologically active CNS composition WELLCOME FOUND (GB) 1996-03-27 CN disclosed
CN-1115756-A Method for preparing pharmaceutically active CNS compounds WELLCOME FOUND (GB) 1996-01-31 CN disclosed
CN-1113487-A Method for preparing pharmaceutically active CNS compounds WELLCOME FOUND (GB) 1995-12-20 CN disclosed
WO-1995007877-A1 PROCESS OF PREPARING 2,3,5-TRIHALOBENZALDEHYDE THE WELLCOME FOUNDATION LIMITED (GB) 1995-03-23 WO disclosed
CN-1052306-A Compounds having pharmacological activity on the central nervous system WELLCOME FOUND (GB) 1991-06-19 CN disclosed