SCHEMBL27555949

SCHEMBL27555949

Cc1c(C(=O)O)cccc1C(=O)O.Cc1nc(C(=O)O)c(-c2ccc3ccccc3c2)[nH]1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.44
▸ ACMSD Q8TDX5 1/20 0.44
▸ DHODH Q02127 7/20 0.43
▸ CTRC Q99895 1/20 0.41
▸ CA12 O43570 1/20 0.40
▸ FABP3 P05413 1/20 0.40
▸ FABP4 P15090 1/20 0.40
▸ FABP5 Q01469 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ CDC7 O00311 1/20 0.39
▸ GLO1 Q04760 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ FTO Q9C0B1 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
SCHEMBL5763126 0.77 KDM4E (0.58) DHODHKDM4EMEN1KMT2A
SCHEMBL7977763 0.73 CTRC (0.53) MAPK14DHODHCTRCCA12KDM4E
Naphthalene SCHEMBL27264766 0.73 NR4A1 (0.59) CA12KDM4EPOLBRAB9AMEN1
SCHEMBL7977822 0.72 KDM4E (0.47) DHODHKDM4ECDC7RAB9AMEN1
Naphthalene SCHEMBL27525627 0.72 NR4A1 (0.57) CA12KDM4EPOLBRAB9AMEN1
Naphthalene SCHEMBL28090924 0.70 NR4A1 (0.55) CA12KDM4ERAB9AMEN1KMT2A
Naphthalene SCHEMBL27919297 0.70 NR4A1 (0.55) CA12KDM4EPOLBRAB9AMEN1
SCHEMBL14705882 0.70 HAO2 (0.44) MAPK14DHODHCA12KDM4ECDC7
SCHEMBL9009356 0.69 ACMSD (0.62) ACMSDDHODHCA12FABP3FABP4
SCHEMBL16670765 0.69 CYP2C9 (0.55) ACMSDDHODHCTRCFABP3FABP4

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
CN-1301255-A Heterocyclically substituted amides, their production and their use BASF AG (DE) 2001-06-27 — — CN disclosed
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