SCHEMBL27489118

SCHEMBL27489118

CCc1c(-c2ccccc2C)nnn1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 3/20 0.41
▸ HEXA P06865 1/20 0.38
▸ HEXB P07686 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ TDO2 P48775 1/20 0.38
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ TYK2 P29597 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ SENP8 Q96LD8 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ DCTPP1 Q9H773 2/20 0.37
▸ TP53 P04637 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ HDAC3 O15379 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
SCHEMBL27507080 0.80 DCTPP1 (0.43) DPP4IDO1TDO2JAK2JAK1
SCHEMBL20149211 0.79 IDO1 (0.46) DPP4HEXAHEXBIDO1TDO2
SCHEMBL27636059 0.69 SLC9A1 (0.47) DPP4IDO1TDO2HDAC3HDAC4
SCHEMBL27657025 0.69 SLC9A1 (0.47) DPP4IDO1TDO2HDAC3HDAC4
SCHEMBL27636024 0.69 SLC9A1 (0.47) DPP4IDO1TDO2HDAC3HDAC4
SCHEMBL16127295 0.67 KCNN4 (0.46) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL27505488 0.67 JAK2 (0.39) DPP4IDO1TDO2JAK2JAK1
SCHEMBL5968451 0.66 NPC1 (0.41) DPP4IDO1TDO2JAK2JAK1
SCHEMBL27636177 0.63 DCTPP1 (0.41) DPP4IDO1TDO2JAK2JAK1
SCHEMBL12457437 0.62 IDO1 (0.38) DPP4IDO1TDO2JAK2JAK1

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
CN-101484560-B Refrigerator oil, compressor oil composition, hydraulic working oil composition, metal working oil composition, heat treatment oil composition, lubricating oil composition for machine tool, and lubricating oil composition NIPPON OIL CORP 2013-03-27 — — CN disclosed
CN-101484560-A Refrigerator oil, compressor oil composition, hydraulic working oil composition, metal working oil composition, heat treatment oil composition, lubricating oil composition for machine tool, and lubricating oil composition NIPPON OIL CORP (JP) 2009-07-15 — — CN disclosed
CN-1214093-C Turbine oil composition NIPPON MITSUBISHI OIL CORP (JP) 2005-08-10 — — CN disclosed
CN-1227258-A Turbine oil composition NIPPON OIL CO LTD (JP) 1999-09-01 — — CN disclosed
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