SCHEMBL10817816

SCHEMBL10817816

Cc1cc(NC(C)(C)C)c2[nH]ncc2n1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.59
▸ LATS1 O95835 3/20 0.40
▸ LATS2 Q9NRM7 3/20 0.40
▸ HTT P42858 1/20 0.37
▸ PTK2 Q05397 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ TGFBR1 P36897 2/20 0.30
▸ MAPT P10636 1/20 0.30
▸ PIM1 P11309 1/20 0.30
▸ PIM2 Q9P1W9 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ RAD52 P43351 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2C8 P10632 1/20 0.30

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
SCHEMBL18879034 0.81 SLC2A1 (0.56) SLC2A1HTTPTK2L3MBTL1TGFBR1
SCHEMBL10803018 0.77 SLC2A1 (0.52) SLC2A1HTTPTK2MAPTPIM1
SCHEMBL10805400 0.76 SLC2A1 (0.97) SLC2A1HTTL3MBTL1MAPTPOLB
SCHEMBL10840466 0.75 SLC2A1 (0.70) SLC2A1HTTL3MBTL1MAPTPOLB
SCHEMBL10507503 0.74 CYP2C19 (0.52) SLC2A1HTTPTK2POLB
SCHEMBL10805234 0.74 SLC2A1 (0.74) SLC2A1HTTL3MBTL1TGFBR1MAPT
SCHEMBL10801863 0.74 SLC2A1 (0.70) SLC2A1HTTL3MBTL1MAPTPOLB
SCHEMBL10804993 0.74 SLC2A1 (0.49) SLC2A1HTTPTK2
SCHEMBL20272422 0.73 SLC2A1 (0.47) SLC2A1HTTPTK2MAPTPOLB
SCHEMBL10801118 0.73 SLC2A1 (0.48) SLC2A1HTT

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
EP-0119774-B1 ANTI-INFLAMMATORY PYRAZOLO PYRIDINES BEECHAM GROUP PLC (GB) 1987-06-24 — — EP disclosed
EP-0119774-A1 Anti-inflammatory pyrazolo pyridines BEECHAM GROUP PLC (GB) 1984-09-26 — — EP disclosed
Send feedback