SCHEMBL24523067

SCHEMBL24523067

CCC(=O)OCCCCCCOc1cc(=O)n(C)c2ccccc12

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.69
SMN1; SMN2 Q16637 7/20 0.59
HPGD P15428 5/20 0.59
LMNA P02545 4/20 0.59
RAB9A P51151 1/20 0.59
BRD4 O60885 6/20 0.58
HTT P42858 4/20 0.57
ALDH1A1 P00352 3/20 0.56
TP53 P04637 1/20 0.56
MEN1 O00255 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL24522892 0.89 KCNA3 (0.70) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522904 0.87 KCNA3 (0.55) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL11394549 0.86 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL11377058 0.86 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL11385072 0.86 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL25493370 0.86 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522709 0.86 KCNA3 (0.66) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522815 0.86 KCNA3 (0.66) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522699 0.85 KCNA3 (0.65) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522981 0.85 KCNA3 (0.65) KCNA3SMN1; SMN2HPGDLMNARAB9A

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
EP-4015512-A1 OPTICALLY ACTIVE DEVICES AMO Ireland (IE) 2022-06-22 EP disclosed