SCHEMBL28979708

SCHEMBL28979708

CCCCCCCCCCCC(=O)On1cc(CO)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.46
OXER1 Q8TDS5 1/20 0.46
ICMT O60725 1/20 0.45
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
IL6ST P40189 2/20 0.42
HPSE Q9Y251 1/20 0.42
HTR7 P34969 2/20 0.41
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
PRKCA P17252 1/20 0.40
PRKCE Q02156 1/20 0.40
RASGRP3 Q8IV61 1/20 0.40

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
SCHEMBL28979727 1.00 CDC25A (0.46) CDC25AOXER1ICMTBCHEACHE
SCHEMBL28979721 1.00 CDC25A (0.46) CDC25AOXER1ICMTBCHEACHE
SCHEMBL28979704 1.00 CDC25A (0.46) CDC25AOXER1ICMTBCHEACHE
SCHEMBL1863216 0.86 EP300 (0.43) CDC25AOXER1ICMTHPSEHTR7
SCHEMBL10609651 0.86 EP300 (0.43) CDC25AOXER1ICMTHPSEHTR7
SCHEMBL7796491 0.86 EP300 (0.43) CDC25AOXER1ICMTHPSEHTR7
SCHEMBL15841884 0.86 EP300 (0.43) CDC25AOXER1ICMTHPSEHTR7
SCHEMBL15841989 0.86 EP300 (0.43) CDC25AOXER1ICMTHPSEHTR7
SCHEMBL8440048 0.86 EP300 (0.43) CDC25AOXER1ICMTHPSEHTR7
SCHEMBL8441598 0.86 EP300 (0.43) CDC25AOXER1ICMTHPSEHTR7

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-115745864-A Indole compound and preparation method and application thereof 深圳零一生命科技有限责任公司 2023-03-07 CN disclosed