SCHEMBL23729787

SCHEMBL23729787

CCOCCCC(=O)NCCNC

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.56
TSHR P16473 3/20 0.46
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 2/20 0.42
NAAA Q02083 1/20 0.41
EPHX2 P34913 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FAAH O00519 2/20 0.40
GAA P10253 1/20 0.40
LMNA P02545 1/20 0.39
CASP2 P42575 1/20 0.39

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
SCHEMBL12412458 0.89 SMN1; SMN2 (0.44) SMN1; SMN2TSHRCASP1CASP7HSD17B10
SCHEMBL23730060 0.87 SMN1; SMN2 (0.60) SMN1; SMN2TSHRCASP1CASP7HSD17B10
SCHEMBL13492963 0.85 SMN1; SMN2 (0.59) SMN1; SMN2TSHRCASP1CASP7HSD17B10
SCHEMBL22794643 0.82 EPHX2 (0.50) SMN1; SMN2TSHREPHX2FAAHGAA
SCHEMBL23729609 0.82 TSHR (0.59) SMN1; SMN2TSHRRAB9AALDH1A1L3MBTL1
SCHEMBL15888692 0.81 TSHR (0.69) SMN1; SMN2TSHRALDH1A1NAAALMNA
SCHEMBL30648925 0.81 SMN1; SMN2 (0.48) SMN1; SMN2TSHRCASP1CASP7HSD17B10
SCHEMBL22296982 0.81 NAAA (0.47) TSHRHSD17B10ALDH1A1NAAAFAAH
SCHEMBL13839061 0.80 FAAH (0.50) SMN1; SMN2TSHRALDH1A1NAAAFAAH
SCHEMBL23729309 0.80 HPGD (0.49) SMN1; SMN2TSHRALDH1A1NAAALMNA

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
WO-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed