SCHEMBL16365976

SCHEMBL16365976

O=C(CCC(=O)N1CCC(C(=O)O)(C(=O)O)CC1)N1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.52
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ GAA P10253 2/20 0.39
▸ NAAA Q02083 1/20 0.39
▸ EPHX2 P34913 1/20 0.38
▸ HSD17B10 Q99714 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
SCHEMBL16365980 0.77 MEN1 (0.48) ATMKMT2AMEN1ALDH1A1NAAA
SCHEMBL8788483 0.77 ATM (0.62) ATML3MBTL1TDP1KMT2AMEN1
SCHEMBL1129113 0.77 ATM (0.62) ATML3MBTL1TDP1KMT2AMEN1
SCHEMBL1520620 0.74 ATM (0.65) ATML3MBTL1TDP1KMT2AMEN1
SCHEMBL16365910 0.74 ADRA1A (0.36) ATMKMT2AALDH1A1NPC1GAA
SCHEMBL19574089 0.72 ATM (0.95) ATML3MBTL1TDP1KMT2AMEN1
SCHEMBL27487132 0.72 ATM (0.85) ATML3MBTL1TDP1KMT2AMEN1
SCHEMBL28366947 0.72 ATM (0.85) ATML3MBTL1TDP1KMT2AMEN1
SCHEMBL10722542 0.72 ATM (0.85) ATML3MBTL1TDP1KMT2AMEN1
SCHEMBL16876990 0.72 L3MBTL1 (0.40) ATML3MBTL1TDP1KMT2AMEN1

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
WO-2014203691-A1 NOVEL MEDICINE CONTAINING PLATINUM COMPLEX 株式会社ヤクルト本社 (JP) 2014-12-24 — — WO disclosed
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