SCHEMBL28302239

SCHEMBL28302239

CCC(c1cc(N)cc(C(=O)O)c1)c1cc(N)cc(C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TPMT P51580 2/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ LMNA P02545 1/20 0.40
▸ DDO Q99489 1/20 0.40
▸ ANPEP P15144 2/20 0.38
▸ ENPEP Q07075 1/20 0.38
▸ HTT P42858 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ PLEC Q15149 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.35
▸ GRM4 Q14833 1/20 0.35
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34

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
SCHEMBL2727093 0.81 FABP3 (0.47) TPMTMEN1KMT2AALDH1A1KDM4E
Butane SCHEMBL6727426 0.78 TPMT (0.50) TPMTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2724083 0.78 TPMT (0.42) TPMTMEN1KMT2AALDH1A1KDM4E
SCHEMBL11226539 0.77 KDM4E (0.42) TPMTMEN1KMT2AALDH1A1KDM4E
SCHEMBL223304 0.75 KDM4E (0.56) TPMTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2820215 0.75 KDM4E (0.56) TPMTMEN1KMT2AALDH1A1KDM4E
SCHEMBL109155 0.75 KDM4E (0.56) TPMTMEN1KMT2AALDH1A1KDM4E
SCHEMBL9397957 0.74 CPN1 (0.48) ALDH1A1KDM4ELMNAANPEPENPEP
SCHEMBL9399958 0.74 ANPEP (0.53) KMT2AALDH1A1ANPEPENPEPGRM4
Octane SCHEMBL7266397 0.73 PLA2G2A (0.56) TPMTMEN1KMT2AALDH1A1MAPT

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
CN-109792019-A Separator for non-aqueous electrolyte battery and nonaqueous electrolyte battery 东丽株式会社 2019-05-21 — — CN disclosed
CN-108368259-A Resin combination 东丽株式会社 2018-08-03 — — CN disclosed
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