SCHEMBL24522815

SCHEMBL24522815

Cn1c(=O)cc(OCCCCCCOC(=O)C(C)(C)C)c2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.66
SMN1; SMN2 Q16637 6/20 0.57
HPGD P15428 5/20 0.57
LMNA P02545 5/20 0.57
RAB9A P51151 1/20 0.57
BRD4 O60885 7/20 0.54
HTT P42858 5/20 0.54
ALDH1A1 P00352 2/20 0.54
TP53 P04637 1/20 0.54
MEN1 O00255 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
KMT2A Q03164 1/20 0.53
THRB P10828 1/20 0.53

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
SCHEMBL24522709 1.00 KCNA3 (0.66) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522892 0.87 KCNA3 (0.70) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24523067 0.86 KCNA3 (0.69) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522981 0.83 KCNA3 (0.65) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24522699 0.83 KCNA3 (0.65) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL24523010 0.83 KCNA3 (0.76) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL11385072 0.81 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL11377058 0.81 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL25493370 0.81 KCNA3 (0.78) KCNA3SMN1; SMN2HPGDLMNARAB9A
SCHEMBL11394549 0.81 KCNA3 (0.78) 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