SCHEMBL11207216

SCHEMBL11207216

COC(=O)Cc1noc2ccc(Cc3ccccc3)c(Cc3ccccc3)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PRNP P04156 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TLR7 Q9NYK1 1/20 0.33

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
SCHEMBL11207898 0.86 KDM4E (0.42) SMN1; SMN2GAAKDM4EALDH1A1LMNA
SCHEMBL11202760 0.72 KCNA5 (0.42) SMN1; SMN2GAAKDM4EALDH1A1LMNA
SCHEMBL31560783 0.71 GLA (0.43) SMN1; SMN2GAAKDM4EALDH1A1LMNA
SCHEMBL6995111 0.70 SMN1; SMN2 (0.59) SMN1; SMN2GAAMEN1KMT2AKDM4E
SCHEMBL24051897 0.69 MTNR1A (0.49) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL6239887 0.66 CYP4F2 (0.59) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL7606587 0.65 HSP90AA1 (0.54) GAAKDM4EALDH1A1LMNAMTNR1A
SCHEMBL13607458 0.65 HSP90AA1 (0.54) SMN1; SMN2KDM4EALDH1A1LMNANPC1
SCHEMBL24303072 0.65 SMN1; SMN2 (0.39) SMN1; SMN2GAAKDM4EALDH1A1LMNA
SCHEMBL1870609 0.65 ALDH1A1 (0.62) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1

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-0094833-A2 Novel 1,2-benzisoxazole derivatives Dainippon Pharmaceutical Co., Ltd. (JP) 1983-11-23 EP disclosed