SCHEMBL28659592

SCHEMBL28659592

CCOC(=O)c1ccc(OC(C)=O)c(C)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
HSD17B10 Q99714 3/20 0.49
KDM4E B2RXH2 3/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
CA12 O43570 4/20 0.46
CA1 P00915 4/20 0.46
CA2 P00918 4/20 0.46
CA7 P43166 4/20 0.46
CA9 Q16790 4/20 0.46
CA14 Q9ULX7 4/20 0.46
ALDH1A1 P00352 2/20 0.44
ACHE P22303 1/20 0.41
PTPN1 P18031 1/20 0.41
CFD P00746 2/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ESR1 P03372 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
SCHEMBL6693943 0.82 TSHR (0.49) TSHRHSD17B10KDM4ENPC1RAB9A
SCHEMBL6689492 0.81 TSHR (0.47) TSHRHSD17B10KDM4ENPC1RAB9A
SCHEMBL6692090 0.81 TSHR (0.47) TSHRHSD17B10KDM4ENPC1RAB9A
SCHEMBL6696651 0.81 TSHR (0.47) TSHRHSD17B10KDM4ENPC1RAB9A
SCHEMBL10336107 0.80 KDM4E (0.53) TSHRHSD17B10KDM4ENPC1RAB9A
SCHEMBL12723861 0.80 ACHE (0.57) TSHRHSD17B10KDM4ERAB9AALDH1A1
SCHEMBL11130469 0.79 CFD (0.58) TSHRHSD17B10KDM4ERAB9AALDH1A1
SCHEMBL6301456 0.79 TSHR (0.49) TSHRHSD17B10KDM4ENPC1RAB9A
SCHEMBL30186934 0.78 TSHR (0.67) TSHRHSD17B10KDM4ENPC1RAB9A
SCHEMBL1872604 0.78 TSHR (0.67) TSHRHSD17B10KDM4ENPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113748021-B Method for producing liquid crystal polyester processed product 本州化学工业株式会社 2024-07-05 CN claimed
CN-113748021-B Method for producing liquid crystal polyester processed product 本州化学工业株式会社 2024-07-05 CN disclosed
CN-113748021-A Method for producing liquid crystal polyester processed product 本州化学工业株式会社 2021-12-03 CN disclosed