SCHEMBL10417200

SCHEMBL10417200

O=C(O)c1ccc(Nc2ccn(-c3ccccc3)n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB11 O95342 1/20 0.62
▸ HDAC6 Q9UBN7 1/20 0.62
▸ LMNA P02545 2/20 0.57
▸ MAPT P10636 3/20 0.56
▸ TSHR P16473 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ ELOVL1 Q9BW60 6/20 0.51
▸ NPC1 O15118 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ AURKA O14965 1/20 0.48
▸ AURKB Q96GD4 1/20 0.48
▸ HCAR3 P49019 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48

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
SCHEMBL10419424 0.91 ABCB11 (0.63) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10418608 0.86 ABCB11 (0.67) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10418593 0.84 ABCB11 (0.72) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10417591 0.84 ABCB11 (0.71) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10419334 0.83 ABCB11 (0.67) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10417573 0.83 MAPT (0.74) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10417259 0.82 ABCB11 (0.55) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10417211 0.82 ELOVL1 (0.61) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10417210 0.80 ABCB11 (0.67) ABCB11HDAC6LMNAMAPTTSHR
SCHEMBL10417641 0.80 ABCB11 (0.71) ABCB11HDAC6LMNAMAPTTSHR

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 6 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
US-4810719-A Anti-inflammator 1,n-diarylpyrazol-3-amines FISONS PLC (GB) 1989-03-07 — — US 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
US-4810719-A Anti-inflammator 1,n-diarylpyrazol-3-amines FISONS PLC (GB) 1989-03-07 — — US 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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