SCHEMBL9369392

SCHEMBL9369392

C=CC=NNC(=O)c1cccnc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ HTT P42858 2/20 0.60
▸ KDM4E B2RXH2 2/20 0.60
▸ LMNA P02545 2/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ GAA P10253 1/20 0.56
▸ GFER P55789 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ KMT2A Q03164 4/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ ATM Q13315 1/20 0.55

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
SCHEMBL9373051 0.82 MAPT (0.64) MAPTALDH1A1HTTKDM4ELMNA
SCHEMBL9373047 0.82 MAPT (0.64) MAPTALDH1A1HTTKDM4ELMNA
SCHEMBL9373058 0.82 MAPT (0.64) MAPTALDH1A1HTTKDM4ELMNA
SCHEMBL6980307 0.81 MAPT (0.62) MAPTALDH1A1KDM4ELMNAL3MBTL1
SCHEMBL9374432 0.79 USP2 (0.74) MAPTALDH1A1HTTKDM4ELMNA
SCHEMBL9372639 0.79 USP2 (0.74) MAPTALDH1A1HTTKDM4ELMNA
SCHEMBL9374438 0.79 USP2 (0.74) MAPTALDH1A1HTTKDM4ELMNA
SCHEMBL28876262 0.78 KMT2A (0.70) MAPTKDM4ELMNAL3MBTL1GFER
SCHEMBL9973629 0.78 CTRC (0.59) MAPTALDH1A1KDM4ELMNAL3MBTL1
SCHEMBL11186049 0.77 ALDH1A1 (0.66) MAPTALDH1A1KDM4ELMNAL3MBTL1

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-0322691-B1 Process for producing 1-acyl-2-pyrazoline derivatives MITSUI TOATSU CHEMICALS (JP) 1994-06-15 — — EP claimed
EP-0322691-B1 Process for producing 1-acyl-2-pyrazoline derivatives MITSUI TOATSU CHEMICALS (JP) 1994-06-15 — — EP disclosed
US-4895947-A Process for producing 1-acyl-2-pyrazoline derivative MITSUI TOATSU CHEMICALS, INC. (JP) 1990-01-23 — — US disclosed
EP-0322691-A1 Process for producing 1-acyl-2-pyrazoline derivatives MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-07-05 — — EP disclosed
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