SCHEMBL9226830

SCHEMBL9226830

CCCCCCCCCCC(CCCCC(C)C)OC(=O)CCCCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.57
MAPT P10636 4/20 0.57
LMNA P02545 6/20 0.56
FFAR4 Q5NUL3 2/20 0.54
FFAR1 O14842 2/20 0.54
ALDH1A1 P00352 3/20 0.54
TSHR P16473 4/20 0.54
GMNN O75496 3/20 0.54
NPSR1 Q6W5P4 3/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
CYP1A2 P05177 2/20 0.54
HSP90AA1 P07900 2/20 0.54
BLM P54132 2/20 0.54
NR1H4 Q96RI1 2/20 0.54
TP53 P04637 1/20 0.54
CYP2C9 P11712 1/20 0.54
HIF1A Q16665 1/20 0.54
GLA P06280 1/20 0.52
PMP22 Q01453 1/20 0.52

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
SCHEMBL28366158 1.00 MAPK1 (0.57) MAPK1MAPTLMNAFFAR4FFAR1
SCHEMBL28883659 0.98 MAPK1 (0.55) MAPK1MAPTLMNAFFAR4FFAR1
SCHEMBL25703866 0.94 MAPK1 (0.64) MAPK1MAPTLMNAALDH1A1TSHR
SCHEMBL29407399 0.94 MAPK1 (0.64) MAPK1MAPTLMNAALDH1A1TSHR
SCHEMBL27425352 0.94 MAPK1 (0.64) MAPK1MAPTLMNAALDH1A1TSHR
SCHEMBL9615401 0.94 MAPK1 (0.64) MAPK1MAPTLMNAALDH1A1TSHR
SCHEMBL29672088 0.94 MAPK1 (0.64) MAPK1MAPTLMNAALDH1A1TSHR
SCHEMBL30577027 0.94 MAPK1 (0.64) MAPK1MAPTLMNAALDH1A1TSHR
SCHEMBL8585394 0.94 MAPK1 (0.64) MAPK1MAPTLMNAALDH1A1TSHR
SCHEMBL23288413 0.94 MAPK1 (0.64) MAPK1MAPTLMNAFFAR4FFAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5457128-A Topical preparation for healing wounds of the skin DOTT LIMITED COMPANY (JP) 1995-10-10 US disclosed
EP-0591546-A1 EXTERNAL PREPARATION FOR CURING DAMAGE TO SKIN DOTT LIMITED COMPANY (JP) 1994-04-13 EP disclosed