SCHEMBL28384353

SCHEMBL28384353

CC(C)(C)OC(=O)N1C(C(C)(F)S(=O)(=O)c2cccc(F)c2)CC(C(C)(F)S(=O)(=O)c2cccc(F)c2)CC1C(C)(F)S(=O)(=O)c1cccc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 9/20 0.41
NR1H3 Q13133 7/20 0.41
GPR119 Q8TDV5 2/20 0.37
NR1I2 O75469 1/20 0.37
CYP3A4 P08684 1/20 0.37
CACNA1B Q00975 1/20 0.37
ALDH1A1 P00352 1/20 0.36
STS P08842 1/20 0.36
GHSR Q92847 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HSD11B1 P28845 1/20 0.35
ABCC9 O60706 1/20 0.35
ABCC8 Q09428 1/20 0.35
KCNJ11 Q14654 1/20 0.35
KCNJ8 Q15842 1/20 0.35
RORC P51449 1/20 0.35

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
SCHEMBL29530166 0.82 GPR119 (0.52) GPR119NR1I2CYP3A4CACNA1BSTS
SCHEMBL17948857 0.82 GPR119 (0.52) GPR119NR1I2CYP3A4CACNA1BSTS
SCHEMBL30833386 0.79 RIPK1 (0.45) NR1H2NR1H3GPR119STSGHSR
SCHEMBL17942320 0.75 GPR119 (0.52) GPR119NR1I2CYP3A4CACNA1BSTS
SCHEMBL29530176 0.75 GPR119 (0.52) GPR119NR1I2CYP3A4CACNA1BSTS
SCHEMBL17942390 0.75 CYP3A4 (0.54) GPR119NR1I2CYP3A4CACNA1BSTS
SCHEMBL17942445 0.74 CACNA1B (0.53) NR1I2CYP3A4CACNA1BALDH1A1HTR2A
SCHEMBL18027382 0.73 HTR2A (0.56) NR1I2CYP3A4CACNA1BHTR2AHTR2C
SCHEMBL30833419 0.73 RIPK1 (0.47) NR1H2NR1H3GPR119STSHTR2A
SCHEMBL30833494 0.73 NR1H2 (0.45) NR1H2NR1H3GPR119NR1I2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118164961-A 4-Methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2024-06-11 CN disclosed
CN-111393414-B 4-Methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2024-05-07 CN disclosed
CN-111393414-A 4-methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2020-07-10 CN disclosed
CN-107428719-B 4-methylsulfonyl substituted piperidine urea compounds for the treatment of Dilated Cardiomyopathy (DCM) 迈奥卡迪亚公司 2020-03-27 CN disclosed