SCHEMBL22912270

SCHEMBL22912270

C/C=C1/C=CC(c2cc(C(F)F)nc(SCCC(O)c3ccccc3)n2)=CN1Cc1ccc(OC)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.32
▸ CSF1R P07333 1/20 0.31
▸ PDE2A O00408 4/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL22912307 0.79 NPC1 (0.33) CSF1RPDE2AMAPK1MEN1LMNA
SCHEMBL22912306 0.70 L3MBTL1 (0.35) SMN1; SMN2TDP1CSF1RMAPK1MEN1
SCHEMBL20985647 0.63 SDHB (0.51) —
SCHEMBL22912212 0.61 SDHB (0.46) PDE2A
SCHEMBL28307428 0.61 DRD4 (0.30) —
SCHEMBL26313133 0.60 SDHB (0.47) TDP1MEN1KMT2A
SCHEMBL23503845 0.59 VCP (0.40) SMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL29976635 0.58 TP53 (0.37) SMN1; SMN2PDE2AMAPK1MEN1LMNA
SCHEMBL19805988 0.57 SDHB (0.53) SMN1; SMN2PDE2AMAPK1LMNA
SCHEMBL20985662 0.55 SDHB (0.42) PDE2AMEN1LMNAKMT2A

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-3484854-B1 APOPTOSIS INHIBITORS NAT INSTITUTE OF BIOLOGICAL SCIENCES BEIJING (CN) 2021-01-20 — — EP disclosed
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