SCHEMBL25527239

SCHEMBL25527239

O=C(O)CCCOC(=O)CCS

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.50
ACE P12821 1/20 0.43
LMNA P02545 3/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
NPC1 O15118 1/20 0.41
TSHR P16473 4/20 0.40
NFKB1 P19838 1/20 0.40
PMP22 Q01453 1/20 0.40
ALDH1A1 P00352 1/20 0.39
DGKA P23743 1/20 0.38
CAMK2A Q9UQM7 1/20 0.37
ENPEP Q07075 2/20 0.36
GSTK1 Q9Y2Q3 1/20 0.36
GABRR3 A8MPY1 1/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
HDAC3 O15379 1/20 0.36
GABBR2 O75899 1/20 0.36
CYP1A2 P05177 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL16255470 0.92 FOLH1 (0.52) FOLH1ACELMNASLC22A6NPC1
SCHEMBL25527247 0.86 ACE (0.46) FOLH1ACELMNASLC22A6TSHR
SCHEMBL99058 0.86 DGKA (0.43) FOLH1ACETSHRALDH1A1DGKA
SCHEMBL97503 0.86 NAAA (0.43) FOLH1ACENPC1TSHRALDH1A1
SCHEMBL11352490 0.85 FOLH1 (0.60) FOLH1LMNASLC22A6NPC1TSHR
SCHEMBL5158770 0.84 FOLH1 (0.46) FOLH1LMNASLC22A6NPC1TSHR
SCHEMBL6603463 0.84 NAAA (0.46) TSHRALDH1A1DGKABLMNPSR1
SCHEMBL98181 0.84 NAAA (0.46) TSHRALDH1A1DGKABLMNPSR1
SCHEMBL98936 0.84 NAAA (0.46) TSHRALDH1A1DGKABLMNPSR1
SCHEMBL6602344 0.84 NAAA (0.46) TSHRALDH1A1DGKABLMNPSR1

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
US-20230152696-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed