SCHEMBL4262832

SCHEMBL4262832

CCOC(=O)c1ccc(C(=O)OCC)c(O)c1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.65
CA12 O43570 6/20 0.63
CA1 P00915 6/20 0.63
CA2 P00918 6/20 0.63
CA7 P43166 6/20 0.63
CA9 Q16790 6/20 0.63
CA14 Q9ULX7 6/20 0.63
ESR1 P03372 1/20 0.55
ESR2 Q92731 1/20 0.55
ALDH1A1 P00352 3/20 0.55
HSD17B10 Q99714 1/20 0.55
MAPT P10636 2/20 0.51
KDM4E B2RXH2 1/20 0.51
TLR2 O60603 1/20 0.51
NSD2 O96028 1/20 0.51
POLB P06746 1/20 0.51
PKM P14618 1/20 0.51
MPI P34949 1/20 0.51
GRK6 P43250 1/20 0.51
RECQL P46063 1/20 0.51

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
SCHEMBL30960327 1.00 TSHR (0.65) TSHRCA12CA1CA2CA7
SCHEMBL15746273 0.92 TSHR (0.57) TSHRCA12CA1CA2CA7
SCHEMBL3173907 0.92 TSHR (0.57) TSHRCA12CA1CA2CA7
SCHEMBL639072 0.92 ALDH1A1 (0.61) TSHRCA12CA1CA2CA7
SCHEMBL1980259 0.89 TSHR (0.53) TSHRCA12CA1CA2CA7
SCHEMBL27883893 0.89 ALDH1A1 (0.59) TSHRCA12CA1CA2CA7
SCHEMBL10571657 0.87 TSHR (0.73) TSHRCA12CA1CA2CA7
SCHEMBL340364 0.86 CA12 (0.67) TSHRCA12CA1CA2CA7
SCHEMBL11678095 0.86 TSHR (0.55) TSHRCA12CA1CA2CA7
SCHEMBL4209895 0.85 TSHR (0.53) TSHRCA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114635198-A Viscose elastic fiber and preparation method thereof 江苏环鼎纺织科技有限公司 2022-06-17 CN claimed
US-20240247100-A1 CLEAVABLE POLYMERS IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2024-07-25 US disclosed
CN-109031794-B Reflecting sheet, backlight module and display device 合肥京东方光电科技有限公司 2024-01-30 CN disclosed
WO-2023127794-A1 DENTAL CURABLE COMPOSITION AND DENTAL PROSTHESIS COMPRISING BASE MATERIAL AND RESIN LAYER クラレノリタケデンタル株式会社 2023-07-06 WO disclosed
CN-114635198-A Viscose elastic fiber and preparation method thereof 江苏环鼎纺织科技有限公司 2022-06-17 CN disclosed
US-20090173055-A1 COMPOSITE COTTON AND POLYESTER YARN AND METHOD FOR MAKING SAME SILVER SCOTT 2009-07-09 US disclosed
EP-0812818-B1 Esterification process ACMA LTD (GB) 2001-10-31 EP disclosed
EP-1035916-B1 ESTERIFICATION CATALYSTS ACMA LTD (GB) 2001-09-05 EP disclosed
EP-1120392-A1 Catalyst and organometallic composition ACMA Limited (GB) 2001-08-01 EP disclosed
EP-1035916-A1 ESTERIFICATION CATALYSTS ACMA Limited (GB) 2000-09-20 EP disclosed
WO-1999028033-A1 ESTERIFICATION CATALYSTS ACMA LIMITED (GB) 1999-06-10 WO disclosed
US-5866710-A CATALYST COMPRISING THE REACTION PRODUCT OF AN ORTHOESTER OR A CONDENSED ORTHOESTER OF TITANIUM OR ZIRCONIUM, AN ALCOHOL CONTAINING AT LEAST TWO HYDROXYL GROUPS, A 2-HYDROXY ACID AND A BASE. TIOXIDE SPECIALTIES LIMITED (GB) 1999-02-02 US disclosed
EP-0812818-A1 Esterification process TIOXIDE SPECIALTIES LIMITED (GB) 1997-12-17 EP disclosed