SCHEMBL9575749

SCHEMBL9575749

CC(O)(C=O)Cc1ccc(OCCN=C=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACACB O00763 2/20 0.38
ALDH1A1 P00352 4/20 0.36
LMNA P02545 3/20 0.36
EBP Q15125 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
PPARA Q07869 6/20 0.34
PPARD Q03181 5/20 0.34
FAAH O00519 1/20 0.34
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 2/20 0.33
PPARG P37231 1/20 0.33
TSPO P30536 1/20 0.33
MITF O75030 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL9575711 0.88 MIF (0.39) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL9575629 0.86 ACACB (0.34) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL788296 0.80 SMN1; SMN2 (0.50) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL19644362 0.80 SMN1; SMN2 (0.50) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL9614864 0.79 SMN1; SMN2 (0.48) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL5560846 0.77 PPARA (0.38) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL14599710 0.77 SMN1; SMN2 (0.47) ALDH1A1LMNASMN1; SMN2MAPTHPGD
SCHEMBL6027401 0.77 NR5A1 (0.51)
SCHEMBL10455828 0.77 LMNA (0.39) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL3975354 0.76 THRA (0.38) ACACBALDH1A1LMNAEBPSIGMAR1

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-0281941-B1 Coreactive photoinitiators CIBA GEIGY AG (CH) 1993-12-08 EP claimed