SCHEMBL7476463

SCHEMBL7476463

Cc1[c]ccc(S(=O)(=O)c2ccccc2C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.43
KDM4E B2RXH2 4/20 0.41
POLB P06746 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
ALDH1A1 P00352 6/20 0.40
MAPT P10636 5/20 0.39
HTT P42858 1/20 0.39
LMNA P02545 2/20 0.38
MCOLN3 Q8TDD5 2/20 0.38
ABCC9 O60706 1/20 0.38
ABCC8 Q09428 1/20 0.38
KCNJ11 Q14654 1/20 0.38
KCNJ8 Q15842 1/20 0.38
NAMPT P43490 2/20 0.38
NPSR1 Q6W5P4 3/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
HTR6 P50406 1/20 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
SCHEMBL7472311 0.78 HSD11B1 (0.41) HSD11B1KDM4EPOLBCYP3A4CYP2C9
SCHEMBL30513969 0.75 ALDH1A1 (0.56) HSD11B1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL29039876 0.75 ALDH1A1 (0.56) HSD11B1KDM4EPOLBL3MBTL1ALDH1A1
SCHEMBL31092469 0.74 HTR6 (0.57) HSD11B1KDM4EPOLBCYP3A4CYP2C9
SCHEMBL1713160 0.74 HTR6 (0.57) HSD11B1KDM4EPOLBCYP3A4CYP2C9
SCHEMBL29242564 0.74 KDM4E (0.50) HSD11B1KDM4EPOLBCYP3A4CYP2C9
SCHEMBL29468592 0.73 ALDH1A1 (0.55) HSD11B1KDM4EPOLBCYP3A4CYP2C9
SCHEMBL475089 0.73 ALDH1A1 (0.55) HSD11B1KDM4EPOLBCYP3A4CYP2C9
SCHEMBL13241569 0.72 LMNA (0.52) HSD11B1KDM4EL3MBTL1ALDH1A1MAPT
SCHEMBL1448262 0.72 SMN1; SMN2 (0.37) ALDH1A1LMNASMN1; SMN2

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
EP-1194417-A1 PHENOXY FLUOROPYRIMIDINES BAYER AG (DE) 2002-04-10 EP disclosed
WO-2000078733-A1 PHENOXY FLUOROPYRIMIDINES BAYER AKTIENGESELLSCHAFT (DE) 2000-12-28 WO disclosed