SCHEMBL7806397

SCHEMBL7806397

COC(=O)Oc1cccnc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ P2RX7 Q99572 1/20 0.45
▸ GFER P55789 1/20 0.41
▸ SSTR4 P31391 2/20 0.40
▸ HTR2C P28335 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ MKNK1 Q9BUB5 1/20 0.38
▸ MKNK2 Q9HBH9 1/20 0.38
▸ CHRNB2 P17787 1/20 0.38

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
SCHEMBL6639870 0.82 KDM4E (0.50) KDM4EHPGDHSD17B10GFERL3MBTL1
SCHEMBL13458380 0.81 KDM4E (0.51) KDM4EHPGDHSD17B10P2RX7LMNA
SCHEMBL11330373 0.81 P2RX7 (0.43) KDM4EP2RX7GFERSSTR4HTR2C
SCHEMBL11683733 0.81 P2RX7 (0.45) KDM4EP2RX7SSTR4HTR2CL3MBTL1
SCHEMBL29852338 0.81 P2RX7 (0.44) P2RX7SSTR4L3MBTL1GAASMN1; SMN2
SCHEMBL8020420 0.81 P2RX7 (0.44) P2RX7SSTR4L3MBTL1GAASMN1; SMN2
SCHEMBL7626781 0.80 MKNK1 (0.46) P2RX7SSTR4HTR2CMEN1KMT2A
SCHEMBL6384911 0.79 KDM4E (0.47) KDM4EHPGDHSD17B10GFERL3MBTL1
SCHEMBL7816179 0.79 P2RX7 (0.54) KDM4EP2RX7GFERSSTR4HTR2C
SCHEMBL7364217 0.78 L3MBTL1 (0.62) KDM4EL3MBTL1MEN1NPC1GAA

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-1117650-A2 USE OF SUBSTITUTED 5-HYDROXYPYRAZOLES, NOVEL 5-HYDROXYPYRAZOLES, METHODS FOR THE PRODUCTION THEREOF AND AGENTS CONTAINING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2001-07-25 — — EP disclosed
WO-2000020399-A2 USE OF SUBSTITUTED 5-HYDROXYPYRAZOLES, NOVEL 5-HYDROXYPYRAZOLES, METHODS FOR THE PRODUCTION THEREOF AND AGENTS CONTAINING THE SAME BASF AKTIENGESELLSCHAFT (DE) 2000-04-13 — — WO disclosed
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