SCHEMBL17911331

SCHEMBL17911331

CCCCCCCCCC(O)(CCCO)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.44
SIGMAR1 Q99720 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 1/20 0.41
SCN5A Q14524 3/20 0.40
SCN9A Q15858 3/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
STS P08842 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ESR2 Q92731 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
SCHEMBL3809940 0.93 SIGMAR1 (0.46) KMT2AMEN1ALDH1A1SIGMAR1GAA
SCHEMBL3422456 0.93 SIGMAR1 (0.46) KMT2AMEN1ALDH1A1SIGMAR1GAA
SCHEMBL11643873 0.93 SIGMAR1 (0.46) KMT2AMEN1ALDH1A1SIGMAR1GAA
SCHEMBL29161136 0.91 SIGMAR1 (0.45) KMT2AMEN1ALDH1A1SIGMAR1GAA
SCHEMBL28724610 0.91 SIGMAR1 (0.45) KMT2AMEN1ALDH1A1SIGMAR1GAA
SCHEMBL28718402 0.91 SIGMAR1 (0.47) KMT2AMEN1ALDH1A1SIGMAR1SMN1; SMN2
SCHEMBL7606477 0.88 SIGMAR1 (0.42) KMT2ALMNAMEN1MAPK1SIGMAR1
SCHEMBL10011783 0.88 SIGMAR1 (0.42) KMT2AMEN1SIGMAR1GAASCN5A
SCHEMBL27294657 0.86 MEN1 (0.44) KMT2AMEN1SIGMAR1GAASCN5A
Alcohol SCHEMBL28670006 0.85 CYP1A2 (0.45) KMT2ALMNAMEN1ALDH1A1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170100919-A1 HIGH RIGIDITY INTERLAYERS AND LIGHT WEIGHT LAMINATED MULTIPLE LAYER PANELS SOLUTIA INC. (US) 2017-04-13 US disclosed
US-20170100918-A1 HIGH RIGIDITY INTERLAYERS AND LIGHT WEIGHT LAMINATED MULTIPLE LAYER PANELS SOLUTIA INC. (US) 2017-04-13 US disclosed
US-20160200076-A1 HIGH RIGIDITY INTERLAYERS AND LIGHT WEIGHT LAMINATED MULTIPLE LAYER PANELS SOLUTIA INC. (US) 2016-07-14 US disclosed