SCHEMBL29950824

SCHEMBL29950824

OB(O)c1ccc(OCc2c(F)cccc2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
RAB9A P51151 2/20 0.52
KDM4E B2RXH2 1/20 0.52
HPGD P15428 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48
POLB P06746 1/20 0.48
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.45
AR P10275 1/20 0.45
ALKBH1 Q13686 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
GAA P10253 1/20 0.44
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL2559738 0.89 SMN1; SMN2 (0.57) SMN1; SMN2RAB9AKDM4EALDH1A1KMT2A
SCHEMBL2560465 0.86 KMT2A (0.51) SMN1; SMN2RAB9AKDM4EHPGDNPSR1
SCHEMBL15380599 0.84 SMN1; SMN2 (0.56) SMN1; SMN2RAB9AKDM4EHPGDNPSR1
SCHEMBL12584868 0.80 SMN1; SMN2 (0.58) SMN1; SMN2RAB9AKDM4EHPGDNPSR1
SCHEMBL6748837 0.80 SMN1; SMN2 (0.55) SMN1; SMN2RAB9AKDM4EHPGDNPSR1
SCHEMBL27850750 0.78 SMN1; SMN2 (0.53) SMN1; SMN2RAB9AKDM4EHPGDNPSR1
SCHEMBL13236911 0.78 SMN1; SMN2 (0.53) SMN1; SMN2RAB9AKDM4EHPGDNPSR1
SCHEMBL257827 0.77 ENPP2 (0.38)
SCHEMBL6238431 0.77 HPGD (0.53) SMN1; SMN2RAB9AKDM4EHPGDNPSR1
SCHEMBL17514795 0.77 SMN1; SMN2 (0.52) SMN1; SMN2RAB9AKDM4EHPGDNPSR1

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed