SCHEMBL9575711

SCHEMBL9575711

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

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MIF P14174 4/20 0.39
ACACB O00763 2/20 0.37
ALDH1A1 P00352 4/20 0.35
LMNA P02545 3/20 0.35
NAAA Q02083 2/20 0.34
EBP Q15125 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
PPARD Q03181 2/20 0.33
PPARA Q07869 2/20 0.33
FAAH O00519 1/20 0.33
KMT2A Q03164 1/20 0.33
PPARG P37231 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MITF O75030 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL9575749 0.88 ACACB (0.38) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL788296 0.79 SMN1; SMN2 (0.50) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL19644362 0.79 SMN1; SMN2 (0.50) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL9614864 0.78 SMN1; SMN2 (0.48) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL9575629 0.77 ACACB (0.34) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL5560846 0.76 PPARA (0.38) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL6027401 0.76 NR5A1 (0.51)
SCHEMBL10455828 0.76 LMNA (0.39) ACACBALDH1A1LMNAEBPSIGMAR1
SCHEMBL10454958 0.75 SMN1; SMN2 (0.46) ACACBALDH1A1LMNASMN1; SMN2PPARD
SCHEMBL3975354 0.75 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