SCHEMBL9525520

SCHEMBL9525520

CC1=NN(c2ccc(Cl)cc2)C(=O)C1=CN

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 16/20 0.63
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
L3MBTL1 Q9Y468 2/20 0.62
MAPT P10636 2/20 0.53
HTT P42858 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MAPK1 P28482 1/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.53
LMNA P02545 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
SCHEMBL9525774 1.00 AMY1A (0.63) AMY1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL6952163 0.84 KDM4E (0.68) MEN1KMT2AL3MBTL1MAPTHTT
SCHEMBL6952167 0.84 KDM4E (0.68) MEN1KMT2AL3MBTL1MAPTHTT
SCHEMBL11244851 0.84 AMY1A (0.59) AMY1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL9527009 0.82 KDM4E (0.74) AMY1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL28967914 0.80 KMT2A (0.90) AMY1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL28967919 0.80 KMT2A (0.90) AMY1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL9525779 0.80 MEN1 (0.72) AMY1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL9525787 0.80 MEN1 (0.72) AMY1AMEN1KMT2AL3MBTL1MAPT
SCHEMBL9525388 0.79 MEN1 (0.59) AMY1AMEN1KMT2AL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274642-B1 HERBICIDAL AND FUNGICIDAL AGENTS BASED ON SUBSTITUTED PYRAZOLIN-5-ONE DERIVATIVES BAYER AG (DE) 1993-08-11 EP claimed
US-5162528-A Pre- and post-emergence; phytaphthora in tomato plants; rice and wheat BAYER AKTIENGESELLSCHAFT (DE) 1992-11-10 US claimed
US-4909827-A Containing a C6-10 aryl group substituted in position 1 BAYER AKTIENGESELLSCHAFT (DE) 1990-03-20 US claimed
EP-0274642-A2 Herbicidal and fungicidal agents based on substituted pyrazolin-5-one derivatives BAYER AG (DE) 1988-07-20 EP claimed
EP-0274642-B1 HERBICIDAL AND FUNGICIDAL AGENTS BASED ON SUBSTITUTED PYRAZOLIN-5-ONE DERIVATIVES BAYER AG (DE) 1993-08-11 EP disclosed
US-5162528-A Pre- and post-emergence; phytaphthora in tomato plants; rice and wheat BAYER AKTIENGESELLSCHAFT (DE) 1992-11-10 US disclosed
US-5028717-A Herbicidal and fungicidal agents based on substituted pyrazolin-5-one derivatives BAYER AKTIENGESELLSCHAFT (DE) 1991-07-02 US disclosed
US-4909827-A Containing a C6-10 aryl group substituted in position 1 BAYER AKTIENGESELLSCHAFT (DE) 1990-03-20 US disclosed
EP-0274642-A2 Herbicidal and fungicidal agents based on substituted pyrazolin-5-one derivatives BAYER AG (DE) 1988-07-20 EP disclosed