SCHEMBL27846239

SCHEMBL27846239

O=S(=O)(O)c1cc([C@@H]2C=Cc3ccccc3C2)ccc1C=Cc1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAD1 O60671 1/20 0.33
P2RY6 Q15077 1/20 0.33
SUMO2 P61956 2/20 0.32
SUMO1 P63165 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
SENP3 Q9H4L4 2/20 0.32
SENP2 Q9HC62 2/20 0.32
SENP1 Q9P0U3 2/20 0.32
MMP8 P22894 4/20 0.31
MMP3 P08254 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
KCNH2 Q12809 1/20 0.31
ENPP2 Q13822 1/20 0.31

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
SCHEMBL27546542 1.00 RAD1 (0.33) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL28353705 0.99 RAD1 (0.32) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL29485574 0.76 RAD1 (0.33) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL3037366 0.76 RAD1 (0.33) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL29433953 0.75 HTR2A (0.33) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL31279905 0.75 HTR2A (0.33) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL20531084 0.75 RAD1 (0.32) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL29833920 0.74 HTR2A (0.32) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL16934708 0.74 RAD1 (0.33) RAD1P2RY6SUMO2SUMO1SENP7
SCHEMBL11366642 0.71 HTR2A (0.47) RAD1P2RY6SUMO2SUMO1SENP7

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-102257115-B Laundry compositions UNILEVER NV 2013-02-06 CN disclosed
CN-102257115-A Laundry compositions UNILEVER NV 2011-11-23 CN disclosed