SCHEMBL8650273

SCHEMBL8650273

C=CCOC(=O)CCCC(O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
ALDH1A1 P00352 3/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.41
PKM P14618 1/20 0.41
EPHX2 P34913 1/20 0.40
CYP3A4 P08684 3/20 0.35
LMNA P02545 3/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 3/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ATM Q13315 1/20 0.33
FAAH O00519 1/20 0.32
MGLL Q99685 1/20 0.32
USP2 O75604 1/20 0.32
RECQL P46063 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL8605587 0.88 TSHR (0.52) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL11878818 0.85 TSHR (0.59) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL463195 0.83 TSHR (0.70) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL153651 0.83 TSHR (0.77) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL28931215 0.83 TSHR (0.61) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL10834721 0.81 TSHR (0.81) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL3120781 0.81 TSHR (0.81) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL11795597 0.81 TSHR (0.81) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL180289 0.81 TSHR (0.81) TSHRALDH1A1GAATDP1SMN1; SMN2
SCHEMBL5392962 0.81 TSHR (0.81) TSHRALDH1A1GAATDP1SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0562819-B1 Resist coating composition JSR CORP (JP) 1999-12-01 EP disclosed
EP-0562819-A2 Resist coating composition JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1993-09-29 EP disclosed