SCHEMBL13715842

SCHEMBL13715842

O=C(Nc1c[nH]cn1)Nc1nnn[nH]1

nearest known ligand 0.30

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.30
▸ ADORA3 P0DMS8 1/20 0.30
▸ PIM1 P11309 1/20 0.30
▸ ADORA2A P29274 1/20 0.30
▸ ADORA2B P29275 1/20 0.30
▸ ADORA1 P30542 1/20 0.30
▸ FLT3 P36888 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ PIM3 Q86V86 1/20 0.30
▸ AURKB Q96GD4 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
SCHEMBL12057465 0.80 MDM2 (0.33) —
SCHEMBL1148266 0.78 NPC1 (0.32) NPC1ADORA3PIM1ADORA2AADORA2B
SCHEMBL13715630 0.77 MEN1 (0.31) —
SCHEMBL13715831 0.76 KDM4E (0.51) NPC1PIM1RAB9ASMN1; SMN2PIM3
SCHEMBL13715830 0.75 EPHX2 (0.46) NPC1ADORA3PIM1ADORA2AADORA2B
SCHEMBL13715594 0.73 GOT1 (0.40) NPC1ADORA3PIM1ADORA2AADORA2B
SCHEMBL13686685 0.72 — —
SCHEMBL13715731 0.71 KDM4E (0.54) NPC1PIM1RAB9ASMN1; SMN2PIM3
SCHEMBL13715636 0.70 MDM2 (0.63) RAB9ASMN1; SMN2
SCHEMBL13715672 0.70 SMN1; SMN2 (0.57) NPC1ADORA3PIM1ADORA2AADORA2B

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
US-20090203215-A1 METAL POLISHING SLURRY AND CHEMICAL MECHANICAL POLISHING METHOD FUJIFILM CORPORATION (JP) 2009-08-13 — — US disclosed
US-20090203215-A1 METAL POLISHING SLURRY AND CHEMICAL MECHANICAL POLISHING METHOD FUJIFILM CORPORATION (JP) 2009-08-13 — — US disclosed
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