SCHEMBL6995580

SCHEMBL6995580

NC(=O)c1nn(Cc2ccccn2)c(C(N)=O)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
PARP10 Q53GL7 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
PKM P14618 1/20 0.39
KDM4E B2RXH2 3/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PIK3CD O00329 1/20 0.37
PIK3R2 O00459 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
PIK3CG P48736 1/20 0.37
PIK3R5 Q8WYR1 1/20 0.37
PIK3R3 Q92569 1/20 0.37
IKBKB O14920 1/20 0.37

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
SCHEMBL5827229 0.83 ADRA1D (0.40) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1
SCHEMBL6446279 0.83 USP2 (0.44) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1
SCHEMBL6447255 0.82 SLC16A3 (0.42) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1
SCHEMBL6447516 0.81 USP2 (0.50) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1
SCHEMBL6200427 0.81 USP2 (0.42) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1
SCHEMBL7004394 0.81 KDM4E (0.41) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1
SCHEMBL7004142 0.81 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1PKMKDM4E
SCHEMBL7003634 0.78 ADRA1D (0.36) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1
SCHEMBL7004143 0.78 SMN1; SMN2 (0.44) L3MBTL1ALDH1A1KMT2AMEN1KDM4E
Hydrochloric Acid SCHEMBL7991717 0.74 ADRA1D (0.48) ADRA1DL3MBTL1PARP10SIRT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1123296-B1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LTD (GB) 2003-09-17 EP disclosed
US-6333330-B1 Pyrazolopyrimidinone CGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. 2001-12-25 US disclosed