SCHEMBL18184511

SCHEMBL18184511

CCS(=O)(=O)c1cc2c(cc1C)NC(=O)CO2

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 6/20 0.64
▸ THRB P10828 3/20 0.64
▸ MAPT P10636 3/20 0.64
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ PKM P14618 8/20 0.60
▸ LMNA P02545 4/20 0.60
▸ POLB P06746 2/20 0.59
▸ RAB9A P51151 1/20 0.58
▸ GAA P10253 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56

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
SCHEMBL18184455 0.85 TP53 (0.67) TP53THRBMAPTMEN1KMT2A
SCHEMBL16032121 0.84 TP53 (0.66) TP53THRBMAPTMEN1KMT2A
SCHEMBL25010388 0.84 TP53 (0.71) TP53THRBMAPTMEN1KMT2A
SCHEMBL24809087 0.83 TP53 (0.64) TP53THRBMAPTMEN1KMT2A
SCHEMBL20364522 0.82 TP53 (0.63) TP53THRBMAPTMEN1KMT2A
SCHEMBL2953764 0.80 MMP12 (0.64) TP53THRBMAPTMEN1KMT2A
SCHEMBL20703688 0.78 ALDH1A1 (0.60) TP53THRBMAPTMEN1KMT2A
SCHEMBL25009096 0.78 PKM (0.70) TP53THRBMAPTPKMLMNA
SCHEMBL25009515 0.77 PKM (0.80) TP53THRBMAPTPKMLMNA
SCHEMBL25009511 0.77 MEN1 (1.00) TP53THRBMAPTMEN1KMT2A

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-2016172631-A2 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-10-27 — — WO disclosed
Send feedback