SCHEMBL10417635

SCHEMBL10417635

FC(F)(F)c1cccc(-n2ccc(Nc3cccnc3)n2)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.60
▸ PHGDH O43175 1/20 0.49
▸ NOTUM Q6P988 2/20 0.47
▸ CTSC P53634 1/20 0.47
▸ TSHR P16473 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ AURKA O14965 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ KDM1A O60341 1/20 0.43
▸ EPHX2 P34913 1/20 0.42
▸ IL1B P01584 1/20 0.42
▸ NLRP3 Q96P20 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL28733754 0.86 KIF11 (0.50) KIF11CTSCTSHRKDM1AEPHX2
SCHEMBL10417190 0.86 ALDH1A1 (0.55) NOTUMALDH1A1KMT2AMEN1AURKA
SCHEMBL10418651 0.81 KIF11 (0.39) KIF11KDM4E
SCHEMBL31013382 0.79 KIF11 (0.47) KIF11CTSCTSHRALDH1A1AURKA
SCHEMBL9279109 0.79 ALDH1A1 (0.45) NOTUMALDH1A1KMT2AMEN1KDM1A
SCHEMBL10417209 0.78 ABCB11 (0.67) NOTUMALDH1A1KMT2AMEN1POLB
SCHEMBL10226426 0.77 NOTUM (0.52) NOTUMALDH1A1KMT2AMEN1KDM1A
SCHEMBL27685302 0.76 KDM1A (0.49) KIF11ALDH1A1KMT2AMEN1AURKA
SCHEMBL10417304 0.75 LMNA (0.45) NOTUMALDH1A1KMT2AMEN1KDM4E
SCHEMBL20172492 0.72 KIF11 (0.66) KIF11CTSCTSHRKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0178035-B1 ANTI-INFLAMMATORY 1,N-DIARYLPYRAZOL-3-AMINES, COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION FISONS plc (GB) 1990-01-03 — — EP claimed
EP-0178035-A1 Anti-inflammatory 1,N-diarylpyrazol-3-amines, compositions containing them and processes for their preparation FISONS plc (GB) 1986-04-16 — — EP claimed
EP-0178035-B1 ANTI-INFLAMMATORY 1,N-DIARYLPYRAZOL-3-AMINES, COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION FISONS plc (GB) 1990-01-03 — — EP disclosed
EP-0178035-A1 Anti-inflammatory 1,N-diarylpyrazol-3-amines, compositions containing them and processes for their preparation FISONS plc (GB) 1986-04-16 — — EP disclosed
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