SCHEMBL9390789

SCHEMBL9390789

O=C(O)CCCC(C(=O)O)(C1CCCC2OC2CCC2OC2CC1)C1CCCC2OC2CCC2OC2CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 14/20 0.33
PPM1B O75688 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
PMP22 Q01453 1/20 0.31
TFPI2 P48307 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
THPO P40225 1/20 0.31

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
SCHEMBL205212 0.87 TBXA2R (0.34) TBXA2RPPM1BKDM4EGMNNLMNA
SCHEMBL19148632 0.84 ALDH1A1 (0.39) LMNAPMP22TSHRNFKB1
SCHEMBL668614 0.82 ALDH1A1 (0.42) LMNAPMP22TSHRNFKB1
SCHEMBL19148633 0.82 ALDH1A1 (0.42) LMNAPMP22TSHRNFKB1
SCHEMBL30996895 0.80 ITGB3 (0.33) TBXA2RPPM1B
SCHEMBL31554981 0.78 LMNA (0.34) LMNAPMP22TSHRNFKB1
SCHEMBL874180 0.77 TSHR (0.46) LMNAPMP22TSHRNFKB1
SCHEMBL17910033 0.76 EPHX1 (0.43) LMNAPMP22TSHRNFKB1
SCHEMBL15281942 0.76 LMNA (0.33) LMNAPMP22TSHRNFKB1
SCHEMBL5674220 0.75 PPM1B (0.34) TBXA2RPPM1BTSHR

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-1994014906-A1 BINDER COMPOSITION FOR POWDER PAINTS DSM N.V. (NL) 1994-07-07 WO disclosed