SCHEMBL25985696

SCHEMBL25985696

COC(=O)/C(N)=C1\COCCN1N

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
GLA P06280 1/20 0.33
BLM P54132 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
MGLL Q99685 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 2/20 0.32
HTT P42858 1/20 0.32
POLB P06746 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
USP2 O75604 1/20 0.30

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
SCHEMBL25985689 0.73 L3MBTL1 (0.32) SMN1; SMN2ALDH1A1
SCHEMBL26375601 0.67 KDM4E (0.31) KDM4E
SCHEMBL19149967 0.66 ALDH1A1 (0.36) RECQLSMN1; SMN2BLMALDH1A1HPGD
SCHEMBL20144462 0.61 RECQL (0.40) RECQLSMN1; SMN2GLABLMALDH1A1
SCHEMBL3213071 0.60
SCHEMBL23673842 0.60 ALDH1A1 (0.52) RECQLSMN1; SMN2GLABLMALDH1A1
SCHEMBL27451173 0.57 ALDH1A1 (0.49) RECQLSMN1; SMN2GLABLMALDH1A1
SCHEMBL5619859 0.57 ALDH1A1 (0.58) RECQLSMN1; SMN2GLAALDH1A1HPGD
SCHEMBL7916442 0.56
SCHEMBL13881363 0.56 GRIK1 (0.35) ALDH1A1HPGDALOX15HSD17B10MEN1

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-3870578-B1 THERAPEUTIC COMPOUNDS C4X DISCOVERY LTD (GB) 2023-08-16 EP disclosed