SCHEMBL2031145

SCHEMBL2031145

c1ccc(Oc2ccccc2COCc2ccccc2Oc2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.60
SLC6A4 P31645 6/20 0.58
SLC6A2 P23975 3/20 0.58
RIPK1 Q13546 1/20 0.58
FFAR1 O14842 1/20 0.50
CYP19A1 P11511 1/20 0.47
MAOA P21397 1/20 0.46
LTA4H P09960 1/20 0.46
TSHR P16473 1/20 0.46
FFAR4 Q5NUL3 2/20 0.46
HTR2A P28223 4/20 0.45
SLC6A3 Q01959 2/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL29669692 1.00 HRH1 (0.60) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL536921 0.86 LTA4H (0.52) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL3787055 0.85 SLC6A4 (0.53) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL28044355 0.85 FFAR1 (0.65) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL1582080 0.84 SLC6A4 (0.65) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL2088976 0.83 HRH1 (0.56) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL10942713 0.83 HRH1 (0.56) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL2088979 0.83 SLC6A4 (0.59) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL3334897 0.82 HRH1 (0.64) HRH1SLC6A4SLC6A2RIPK1FFAR1
SCHEMBL313132 0.80 HRH1 (0.62) HRH1SLC6A4SLC6A2RIPK1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5155799-A None JP disclosed
CN-113444111-A Novel benzodiazepine derivative and use thereof 尹图赛利有限公司 2021-09-28 CN disclosed
JP-2011128217-A OPTICAL DROP CABLE HITACHI CABLE LTD 2011-06-30 JP disclosed
EP-1262100-A1 FAN TYPE CHEMICALS DIFFUSING DEVICE Fumakilla Limited (JP) 2002-12-04 EP disclosed
US-6284814-B1 POLYOLEFINS, POLYSTYRENES, POLYESTERS, OR MIXTURES THEREOF, AND LIQUID ANTIMICROBIAL AGENT, WHEREIN THE MASTERBATCH COMPOSITION IS AT LEAST SUBSTANTIALLY DEVOID OF ANY CARRIER COMPONENT FOR THE ANTIMICROBIAL AGENT. CHAKRA V. GUPTA 2001-09-04 US disclosed
US-5665763-A ANTIPICORNAVIRAL AGENTS SANOFI, S.A. (FR) 1997-09-09 US disclosed
US-5567717-A COMBATTING PICORNAVIRUSES STERLING WINTHROP, INC. (US) 1996-10-22 US disclosed
US-5514679-A TREATMENT OF PICORNAVIRUS INFECTIONS STERLING WINTHROP INC. (US) 1996-05-07 US disclosed
WO-1995031439-A1 THERAPEUTIC PHENOXYALKYLPYRIDAZINES AND INTERMEDIATES THEREFOR SANOFI WINTHROP, INC. (US) 1995-11-23 WO disclosed
JP-H05155799-A METHOD FOR PURIFYING P-HALODIFLUOROMETHOXYNEOPHYL M-PHENOXYBENZYL ETHERS MITSUI TOATSU CHEM INC 1993-06-22 JP disclosed
EP-0437784-A1 Imidazolidine derivatives, process for producing the same and pesticides containing the same ISHIHARA SANGYO KAISHA, LTD. (JP) 1991-07-24 EP disclosed
EP-0421385-A1 Process for producing p-hydroxyneophyl m-phenoxybenzyl ether MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-04-10 EP disclosed