SCHEMBL7764255

SCHEMBL7764255

O=C(O)c1ccc(CCc2ccccc2C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.72
FOLH1 Q04609 1/20 0.58
ALDH1A1 P00352 5/20 0.53
POLB P06746 1/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ADRB2 P07550 1/20 0.53
PPARA Q07869 1/20 0.50
SLC16A3 O15427 3/20 0.49
PTGER4 P35408 2/20 0.49
PTGER2 P43116 2/20 0.49
LMNA P02545 1/20 0.49
PTGER1 P34995 1/20 0.49
PTGER3 P43115 1/20 0.49
HTT P42858 1/20 0.48
MAPT P10636 1/20 0.48
HDAC1 Q13547 1/20 0.47

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
SCHEMBL10641089 0.90 TSHR (0.68) TSHRFOLH1ALDH1A1POLBHPGD
SCHEMBL29975597 0.89 FOLH1 (0.66) TSHRFOLH1ALDH1A1L3MBTL1ADRB2
SCHEMBL166927 0.89 FOLH1 (0.66) TSHRFOLH1ALDH1A1L3MBTL1ADRB2
Hydrochloric Acid SCHEMBL7699238 0.87 FOLH1 (0.63) TSHRFOLH1ALDH1A1L3MBTL1ADRB2
SCHEMBL8702953 0.87 FOLH1 (0.63) TSHRFOLH1ALDH1A1L3MBTL1ADRB2
SCHEMBL6260082 0.87 TSHR (0.58) TSHRALDH1A1HSD17B10ADRB2PPARA
SCHEMBL30365583 0.84 FOLH1 (0.76) TSHRFOLH1ALDH1A1POLBHPGD
SCHEMBL70392 0.84 FOLH1 (0.76) TSHRFOLH1ALDH1A1POLBHPGD
SCHEMBL5515624 0.84 FOLH1 (0.56) TSHRFOLH1ALDH1A1L3MBTL1ADRB2
SCHEMBL6387117 0.84 ALDH1A1 (0.67) TSHRFOLH1ALDH1A1L3MBTL1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001087829-A1 BISACYLGUANIDINE MERCK PATENT GMBH (DE) 2001-11-22 WO disclosed
EP-0332425-B1 PROCESS FOR REFINING 1,3-DIMETHYL-2-IMIDAZOLIDINONE AND A PROCESS FOR PREPARING AN AROMATIC POLYAMIDE BY USE OF THE REFINED PRODUCT MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 EP disclosed
US-5075406-A Solution polymerization of polyamides in solvent purified by adsorption on magnesia, alumina, silica or mixed oxides MITSUI TOATSU CHEMICALS, INC. (JP) 1991-12-24 US disclosed
US-5011936-A Using composite salt consisting of at least two of silica, magnesia and alumina MITSUI TOATSU CHEMICALS, INC. (JP) 1991-04-30 US disclosed
US-4923951-A DIISOCYANTE, ALKALI OR ALKALINE EARTH METAL CATALYST MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1990-05-08 US disclosed
EP-0332425-A1 Process for refining 1,3-dimethyl-2-imidazolidinone and a process for preparing an aromatic polyamide by use of the refined product MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-09-13 EP disclosed
EP-0328342-A2 Process for producing aromatic polyamides MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-08-16 EP disclosed