SCHEMBL13327385

SCHEMBL13327385

CCCC1(CCC)c2ccccc2-c2cc(NC(=O)c3ccc(C(=O)Nc4cc5c(cc4O)C(CCC)(CCC)c4ccccc4-5)c(C)c3)c(O)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 3/20 0.38
KMT2A Q03164 6/20 0.38
MEN1 O00255 5/20 0.38
PDK2 Q15119 2/20 0.38
GAA P10253 1/20 0.37
APEX1 P27695 1/20 0.37
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
TERT O14746 1/20 0.36
TOP1 P11387 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL13327368 0.88 KCNMA1 (0.42) KCNMA1KMT2ARAB9ASMN1; SMN2HTT
SCHEMBL8964804 0.74 MAPT (0.51) KMT2AMEN1GAARAB9ANPC1
SCHEMBL3291016 0.72 KCNMA1 (0.53) KCNMA1KMT2AMEN1GAARAB9A
SCHEMBL17084351 0.70 ALDH1A1 (0.42) PDK2APEX1HTTALDH1A1
SCHEMBL17084359 0.69 PDK2 (0.56) PDK2APEX1RAB9ANPC1MAPT
SCHEMBL3291279 0.69 APEX1 (0.41) KMT2AMEN1PDK2GAAAPEX1
SCHEMBL18682531 0.67 APEX1 (0.43) PDK2APEX1
SCHEMBL18838855 0.67 APEX1 (0.38) KMT2APDK2APEX1SMN1; SMN2
SCHEMBL21025425 0.67 PDK2 (0.56) PDK2APEX1RAB9ACYP2C9TDP1
SCHEMBL8964786 0.66 APEX1 (0.39) KMT2AMEN1GAAAPEX1RAB9A

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
US-7713452-B2 Compounds that absorb ultraviolet light, methods of their preparation and optical lenses containing them ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2010-05-11 US disclosed