SCHEMBL949130

SCHEMBL949130

COc1c2ccccc2c(OC)c2cc(S(=O)(=O)OCc3ccccc3Cl)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.42
SLC2A1 P11166 1/20 0.40
PTGS2 P35354 1/20 0.38
PKM P14618 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
IDO1 P14902 2/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 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
SCHEMBL10404455 0.82 HTR1A (0.40) MAPK1KMT2AKDM4EALDH1A1TSHR
SCHEMBL30043755 0.76 SMN1; SMN2 (0.52) MAPK1SLC2A1SMN1; SMN2KDM4EALDH1A1
SCHEMBL600822 0.76 SMN1; SMN2 (0.52) MAPK1SLC2A1SMN1; SMN2KDM4EALDH1A1
SCHEMBL5870554 0.76 TP53 (0.53) MAPK1PKMKMT2AALDH1A1IDO1
SCHEMBL30139585 0.75 HTT (0.44) PTGS2PKMKMT2AALDH1A1IDO1
SCHEMBL949550 0.75 MAPT (0.39) MAPK1SMN1; SMN2KDM4EALDH1A1TSHR
SCHEMBL335568 0.75 HTT (0.44) PTGS2PKMKMT2AALDH1A1IDO1
SCHEMBL28243715 0.75 IDO1 (0.48) KDM4EALDH1A1IDO1MAPTFABP4
SCHEMBL948241 0.74 PRMT5 (0.45) KMT2AALDH1A1TSHRMAPTLMNA
SCHEMBL7542901 0.74 IDO1 (0.44) MAPK1KDM4EALDH1A1IDO1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2258951-B1 PHOTORESPONSIVE GAS-GENERATING MATERIAL, MICROPUMP AND MICROFLUID DEVICE SEKISUI CHEMICAL CO LTD (JP) 2018-08-22 EP disclosed
US-8771612-B2 Photoresponsive gas-generating material, micropump and microfluid device SEKISUI CHEMICAL CO., LTD. (JP) 2014-07-08 US disclosed
US-20140134075-A1 PHOTORESPONSIVE GAS-GENERATING MATERIAL, MICROPUMP AND MICROFLUID DEVICE SEKISUI CHEMICAL CO., LTD. (JP) 2014-05-15 US disclosed
US-20110014096-A1 PHOTORESPONSIVE GAS-GENERATING MATERIAL, MICROPUMP AND MICROFLUID DEVICE SEKISUI CHEMICAL CO., LTD. (JP) 2011-01-20 US disclosed
EP-2258951-A1 PHOTORESPONSIVE GAS-GENERATING MATERIAL, MICROPUMP AND MICROFLUID DEVICE Sekisui Chemical Co., Ltd. (JP) 2010-12-08 EP disclosed