SCHEMBL7007610

SCHEMBL7007610

O=C1Nc2ncc(C(=O)O)cc2/C1=C/Nc1ccc2ncccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.44
NPC1 O15118 8/20 0.43
RAB9A P51151 7/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
MGAM O43451 1/20 0.40
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39

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
SCHEMBL7007615 1.00 PABPC1 (0.44) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5183226 0.86 ALDH1A1 (0.42) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5183228 0.86 ALDH1A1 (0.42) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5427351 0.85 JAK3 (0.44) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5168964 0.85 JAK3 (0.44) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5432246 0.85 NPC1 (0.43) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5172633 0.85 NPC1 (0.43) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5460602 0.84 HTT (0.46) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL5196258 0.84 HTT (0.46) PABPC1NPC1RAB9AALDH1A1MEN1
SCHEMBL7013827 0.80 ALDH1A1 (0.42) NPC1RAB9AALDH1A1MEN1MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1180105-B1 SUBSTITUTED AZA-OXINDOLE DERIVATIVES GLAXO GROUP LTD (GB) 2003-05-14 EP claimed