SCHEMBL28786396

SCHEMBL28786396

CCCC[Sn](CCCC)(CCCC)c1nccnc1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
HTT P42858 2/20 0.36
TSHR P16473 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL29785681 1.00 LMNA (0.36) LMNAHTTTSHRKDM4EMAPT
SCHEMBL114947 0.77
SCHEMBL21552099 0.76 LMNA (0.36) LMNAHTTTSHRKDM4EMAPT
SCHEMBL31319231 0.76 EPHX2 (0.34) LMNA
SCHEMBL23162812 0.74 ALDH1A1 (0.32)
SCHEMBL5179044 0.73 LMNA (0.38) LMNAHTTTSHRKDM4EMAPT
SCHEMBL23162814 0.73
SCHEMBL2213452 0.70 CYP3A4 (0.33)
SCHEMBL1671404 0.69 CYP2D6 (0.32)
SCHEMBL29782963 0.69 CYP2D6 (0.32)

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
CN-114786778-A Therapeutic compounds 基因泰克公司 2022-07-22 CN disclosed