SCHEMBL27362702

SCHEMBL27362702

Cn1ncc(-c2ccccc2C=O)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.46
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36
PTGS1 P23219 2/20 0.35
KCNN4 O15554 1/20 0.35
BRD4 O60885 2/20 0.34
KAT2B Q92831 2/20 0.34
BRD9 Q9H8M2 2/20 0.34
XDH P47989 1/20 0.34
BPTF Q12830 1/20 0.34
PRMT5 O14744 2/20 0.34

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
SCHEMBL14397416 0.77 HIF1A (0.43) HIF1AMEN1LMNATHRBBLM
SCHEMBL378249 0.75
SCHEMBL25731648 0.72 CREBBP (0.45) HIF1AMEN1KMT2APIM1PIM3
SCHEMBL31175932 0.72 KMT2A (0.71) MEN1LMNATHRBBLMKMT2A
SCHEMBL249552 0.72 KMT2A (0.71) MEN1LMNATHRBBLMKMT2A
SCHEMBL15647800 0.70 ADRA1A (0.40) HIF1AMEN1LMNATHRBBLM
SCHEMBL31588841 0.70 KMT2A (0.67) MEN1LMNATHRBBLMKMT2A
SCHEMBL27511393 0.70 KMT2A (0.67) MEN1LMNATHRBBLMKMT2A
SCHEMBL1547476 0.69 TDP1 (0.52) MEN1LMNATHRBBLMKMT2A
SCHEMBL612984 0.69 BRD4 (0.53) BRD4XDHCHRNB1CHRNB2CHRNB4

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
CN-1069315-C Process for prepn. of 1,3-dimethyl-5-fluoro-pyrazole-4-carboxanilides BAYER AG (DE) 2001-08-08 CN disclosed
CN-1161329-A Process for prepn. of 1,3-dimethyl-5-fluoro-pyrazole-4-carboxanilides BAYER AG (DE) 1997-10-08 CN disclosed