SCHEMBL9468060

SCHEMBL9468060

CCN1CCN(C(=O)NC([C]=O)c2ccc(OC(C)=O)cc2)C(=O)C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.34
▸ GLA P06280 1/20 0.34
▸ CYP19A1 P11511 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ POLB P06746 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ SLC22A6 Q4U2R8 1/20 0.32
▸ SLC22A8 Q8TCC7 1/20 0.32
▸ SLC22A11 Q9NSA0 1/20 0.32
▸ TSHR P16473 2/20 0.32
▸ THRB P10828 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ GAA P10253 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ LMNA P02545 2/20 0.31
▸ ABCB11 O95342 1/20 0.31

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
SCHEMBL10547877 0.89 KMT2A (0.40) KMT2APOLBMAPTTHRBHSD17B10
SCHEMBL10762794 0.88 POLB (0.33) KMT2ASMN1; SMN2POLBMAPTPDE3A
SCHEMBL10541152 0.87 CTSL (0.41) KMT2ASMN1; SMN2POLBMAPTTDP1
SCHEMBL8626068 0.87 SMN1; SMN2 (0.33) SMN1; SMN2POLBMAPTPDE3ASLC22A6
SCHEMBL6875807 0.85 MAPT (0.39) SMN1; SMN2POLBMAPTPDE3ASLC22A6
SCHEMBL10545939 0.85 MAPT (0.32) KMT2ASMN1; SMN2POLBMAPTPDE3A
SCHEMBL10540280 0.84 POLB (0.39) SMN1; SMN2POLBHSD17B10GAALMNA
SCHEMBL8626971 0.84 POLB (0.38) KMT2ASMN1; SMN2POLBMAPTGAA
SCHEMBL11423312 0.84 MAPT (0.39) KMT2AGLACYP19A1SMN1; SMN2POLB
SCHEMBL11423317 0.84 MAPT (0.39) KMT2AGLACYP19A1SMN1; SMN2POLB

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
US-5185330-A Penicillins/ad/ TOYAMA CHEMICAL CO., LTD. (JP) 1993-02-09 — — US disclosed
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