SCHEMBL28586196

SCHEMBL28586196

COCOc1c(OC)cccc1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.65
MAPK1 P28482 3/20 0.52
PTPN1 P18031 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
TSHR P16473 2/20 0.49
POLB P06746 1/20 0.49
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP1A2 P05177 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
LMNA P02545 4/20 0.45
NPC1 O15118 1/20 0.45

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
SCHEMBL2220154 0.88 PTPN1 (0.51) SMN1; SMN2MAPK1PTPN1L3MBTL1TSHR
SCHEMBL3671710 0.87 SMN1; SMN2 (0.55) SMN1; SMN2MAPK1PTPN1L3MBTL1TSHR
SCHEMBL7567008 0.86 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1PTPN1L3MBTL1TSHR
SCHEMBL7942502 0.86 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1PTPN1L3MBTL1TSHR
SCHEMBL3711484 0.86 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1PTPN1L3MBTL1TSHR
Dimethoxymethane SCHEMBL27820464 0.84 SMN1; SMN2 (0.56) SMN1; SMN2MAPK1L3MBTL1TSHRPOLB
SCHEMBL6550273 0.83 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1PTPN1L3MBTL1ALDH1A1
SCHEMBL6550190 0.83 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1PTPN1L3MBTL1TSHR
SCHEMBL29955198 0.83 ENPP2 (0.53) SMN1; SMN2MAPK1PTPN1L3MBTL1TSHR
SCHEMBL10971500 0.82 SMN1; SMN2 (0.60) SMN1; SMN2MAPK1L3MBTL1TSHRPOLB

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
CN-109152762-B Compound for promoting osteoblast differentiation and inhibiting adipocyte differentiation, preparation method and application thereof 成均生物株式会社 2021-07-13 CN disclosed