SCHEMBL28068079

SCHEMBL28068079

O=S(=O)(c1cccc(OC(F)F)c1)c1ccc2[c]c[nH]c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.41
FBP1 P09467 2/20 0.35
DUT P33316 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
KDM2B Q8NHM5 1/20 0.34
DRD1 P21728 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
ABCC9 O60706 1/20 0.33
ABCC8 Q09428 1/20 0.33

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
SCHEMBL28068077 0.76 AKR1B1 (0.45) HTR6
SCHEMBL22954631 0.75 HTR6 (0.48) HTR6FBP1KDM2BDRD1HDAC3
SCHEMBL5435375 0.70 ALOX15 (0.34) KMT2AATMDRD1DAO
SCHEMBL14572837 0.68 KDM2B (0.48) HTR6FBP1DUTKDM2BDRD1
SCHEMBL12310498 0.68 CA2 (0.55) FBP1DRD1
SCHEMBL113409 0.68 DRD1 (0.44) HTR6FBP1KMT2AKDM2BDRD1
SCHEMBL21233207 0.68 PDE4A (0.46) HTR6FBP1KDM2BDRD1BRD4
SCHEMBL1134333 0.68 TSHR (0.47) HTR6FBP1KMT2AATMKDM2B
SCHEMBL617654 0.66 HTR6 (0.66) HTR6
SCHEMBL22952851 0.66 NR1H2 (0.43) HTR6FBP1KDM2BDRD1

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-105612150-B Sulfonylindole derivatives and process for producing the same 株式会社大熊制药 2018-04-10 CN disclosed
CN-105612150-A Sulfonylindole derivatives and process for producing the same DAE WOONG PHARMA 2016-05-25 CN disclosed