SCHEMBL9526503

SCHEMBL9526503

Cc1ccccc1N1N=C(c2ccccc2)C(=CNc2ccccc2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.40
MEN1 O00255 7/20 0.39
KMT2A Q03164 7/20 0.39
MAPT P10636 6/20 0.39
TDP1 Q9NUW8 4/20 0.39
LMNA P02545 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 2/20 0.39
ALOX12 P18054 1/20 0.39
GAA P10253 3/20 0.39
POLB P06746 2/20 0.39
RECQL P46063 1/20 0.39
GALK1 P51570 1/20 0.39
BLM P54132 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GRM1 Q13255 1/20 0.36
MGLL Q99685 1/20 0.36
KAT8 Q9H7Z6 1/20 0.35

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
SCHEMBL9526497 1.00 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9525658 0.93 CCKBR (0.38) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9525814 0.92 MEN1 (0.40) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9525608 0.89 CCKBR (0.39) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9727237 0.85 KDM4E (0.45) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9727241 0.85 KDM4E (0.45) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9524477 0.78 MEN1 (0.47) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9524853 0.75 MAPT (0.50) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9524844 0.75 MAPT (0.50) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL9525479 0.72 KMT2A (0.48) ALDH1A1MEN1KMT2AMAPTTDP1

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 3 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
EP-0274642-B1 HERBICIDAL AND FUNGICIDAL AGENTS BASED ON SUBSTITUTED PYRAZOLIN-5-ONE DERIVATIVES BAYER AG (DE) 1993-08-11 EP disclosed