SCHEMBL27809659

SCHEMBL27809659

Clc1ccc(C2CCOC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.46
DRD2 P14416 1/20 0.41
PRKAB2 O43741 1/20 0.40
PRKAG1 P54619 1/20 0.40
PRKAA2 P54646 1/20 0.40
PRKAA1 Q13131 1/20 0.40
PRKAG3 Q9UGI9 1/20 0.40
PRKAG2 Q9UGJ0 1/20 0.40
PRKAB1 Q9Y478 1/20 0.40
SERPINE1 P05121 1/20 0.40
SRD5A1 P18405 2/20 0.39
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
SLC6A2 P23975 3/20 0.38
SLC6A3 Q01959 3/20 0.38
TAAR1 Q96RJ0 1/20 0.38
HTR6 P50406 1/20 0.38
SLC18A3 Q16572 1/20 0.38
KDM1A O60341 1/20 0.37
MAOA P21397 1/20 0.37

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
SCHEMBL15300702 0.88 HTR3A (0.47) HTR3ADRD2PRKAB2PRKAG1PRKAA2
SCHEMBL25247362 0.87 HTR3A (0.48) HTR3ADRD2PRKAB2PRKAG1PRKAA2
SCHEMBL30455997 0.82 HTR3A (0.47) HTR3ADRD2SRD5A1SLC6A2SLC6A3
SCHEMBL6362142 0.79 PRMT5 (0.35) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL21051446 0.79 ESR2 (0.50) ALOX12
SCHEMBL20408758 0.79 PRMT5 (0.38) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL15300665 0.79 KDM1A (0.45) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL21051323 0.79 ESR2 (0.50) ALOX12
SCHEMBL16979032 0.79 PRMT5 (0.38) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL30912540 0.79 PRMT5 (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102083794-A Urea compounds as gamma secretase modulators AMGEN INC 2011-06-01 CN claimed
CN-108383858-B Derivatives of imidazothiadiazoles and imidazopyrazines for the treatment of platelet aggregation 百时美施贵宝公司 2024-09-20 CN disclosed
CN-104583218-A Imidazothiadiazole and imidazopyrazine derivatives as protease activated receptor 4(PAR4) inhibitors for the treatment of platelet aggregation BRISTOL MYERS SQUIBB CO 2015-04-29 CN disclosed
CN-104292190-A Synthesis method for beta-brominated tetrahydrofuran compound HARBIN INST OF TECHNOLOGY 2015-01-21 CN disclosed
CN-102083794-A Urea compounds as gamma secretase modulators AMGEN INC 2011-06-01 CN disclosed