SCHEMBL8588423

SCHEMBL8588423

CC(O)COCCC(C)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.44
▸ TP53 P04637 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GMNN O75496 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ PMP22 Q01453 1/20 0.33
▸ SHBG P04278 1/20 0.32

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
SCHEMBL8588419 1.00 HSD17B10 (0.44) HSD17B10TP53TDP1SMN1; SMN2KDM4E
SCHEMBL21564929 0.83 SPHK2 (0.33) SHBG
SCHEMBL175125 0.77 TP53 (0.41) TP53SMN1; SMN2KDM4EGMNNLMNA
SCHEMBL12321734 0.77 TP53 (0.41) TP53SMN1; SMN2KDM4EGMNNLMNA
SCHEMBL21155241 0.74 TP53 (0.38) TP53SMN1; SMN2KDM4EGMNNLMNA
SCHEMBL28432329 0.74 HSD17B10 (0.47) HSD17B10TDP1SMN1; SMN2
SCHEMBL16754247 0.74 KDM4E (0.44) HSD17B10TDP1SMN1; SMN2KDM4ELMNA
SCHEMBL13568045 0.73 HSD17B10 (0.67) HSD17B10TDP1LMNAMAPT
SCHEMBL24022476 0.73 SHBG (0.33) SMN1; SMN2SHBG
SCHEMBL16754251 0.72 KDM4E (0.45) HSD17B10SMN1; SMN2KDM4ELMNA

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
WO-1998050031-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 — — WO disclosed
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