SCHEMBL11122001

SCHEMBL11122001

C=CNC(=O)OCCOC(=O)NC=C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.41
ALDH1A1 P00352 3/20 0.41
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
HSD17B10 Q99714 1/20 0.41
ACHE P22303 5/20 0.37
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
RECQL P46063 1/20 0.32
RAB9A P51151 1/20 0.32
HPGD P15428 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CYP2D6 P10635 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRNB2 P17787 1/20 0.32
NFKB1 P19838 1/20 0.32
CHRM3 P20309 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
SCHEMBL2056773 0.93 TSHR (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL21570869 0.90 TSHR (0.48) TSHRALDH1A1ACHECYP3A4SMN1; SMN2
SCHEMBL12975855 0.89 TSHR (0.37) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL2116165 0.88
SCHEMBL2056762 0.88 TSHR (0.52) TSHRALDH1A1ACHECYP3A4HPGD
SCHEMBL3686781 0.86
SCHEMBL27803239 0.84 KDM4E (0.40) TSHRALDH1A1ACHESMN1; SMN2HPGD
SCHEMBL21787200 0.84 ACHE (0.41) TSHRALDH1A1ACHECYP3A4SMN1; SMN2
SCHEMBL640238 0.84 THRB (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL5924841 0.83 HPGD (0.57) TSHRALDH1A1ACHESMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114839839-A Photosensitive resin composition and dry film anti-corrosion laminated body 杭州福斯特电子材料有限公司 2022-08-02 CN claimed
CN-114839839-A Photosensitive resin composition and dry film anti-corrosion laminated body 杭州福斯特电子材料有限公司 2022-08-02 CN disclosed
EP-3818401-A1 WATER EXTRACTABLE OPHTHALMIC DEVICES Bausch & Lomb Incorporated (US) 2021-05-12 EP disclosed
EP-3794388-A1 WATER EXTRACTABLE OPHTHALMIC DEVICES Bausch & Lomb Incorporated (US) 2021-03-24 EP disclosed
EP-0122453-A1 Process for the preparation of polyhydroxy compounds which contain blocked and optionally free hydroxy groups, polyhydroxy compounds obtained by this process and coating compositions based on these polyhydroxy compounds BAYER AG (DE) 1984-10-24 EP disclosed
US-3942996-A Radiation sensitive recording material AGFA-GEVAERT AKTIENGESELLSCHAFT (DT) 1976-03-09 US disclosed