SCHEMBL30833387

SCHEMBL30833387

Cc1cc(NC(=O)N2CCCCC2C(C)(F)S(=O)(=O)c2cccc(F)c2)cnn1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 1/20 0.41
ABCC8 Q09428 1/20 0.41
KCNJ11 Q14654 1/20 0.41
KCNJ8 Q15842 1/20 0.41
USP2 O75604 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 2/20 0.38
WNT3 P56703 1/20 0.38
SFRP1 Q8N474 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
MAPT P10636 1/20 0.37
EPHX2 P34913 2/20 0.37
ALDH1A1 P00352 3/20 0.37
RIPK1 Q13546 1/20 0.37
HPGD P15428 1/20 0.36
KCNQ1 P51787 1/20 0.36
PRMT5 O14744 2/20 0.36
WDR77 Q9BQA1 2/20 0.36

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
Trifluoroacetic Acid SCHEMBL30833404 0.86 RORC (0.40) ABCC9ABCC8KCNJ11KCNJ8USP2
SCHEMBL30833424 0.85 EGFR (0.39) ABCC9ABCC8KCNJ11KCNJ8USP2
SCHEMBL30833438 0.85 NPSR1 (0.39) ABCC9ABCC8KCNJ11KCNJ8USP2
SCHEMBL17942430 0.83 TSHR (0.47) ABCC9ABCC8KCNJ11KCNJ8USP2
SCHEMBL30833400 0.83 TSHR (0.47) ABCC9ABCC8KCNJ11KCNJ8USP2
SCHEMBL30833383 0.82 MEN1 (0.42) ABCC9ABCC8KCNJ11KCNJ8USP2
SCHEMBL30833388 0.81 RIPK1 (0.38) ABCC9ABCC8KCNJ11KCNJ8USP2
SCHEMBL30833449 0.80 RORC (0.42) USP2MEN1KMT2ATSHRWNT3
SCHEMBL30833386 0.76 RIPK1 (0.45) MEN1KMT2AWNT3SFRP1RIPK1
SCHEMBL17942547 0.75 RORC (0.42) TSHRRIPK1

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 2 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