SCHEMBL9957302

SCHEMBL9957302

COc1c(OC(C)=O)cccc1OS(C)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.49
PTPN1 P18031 1/20 0.47
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 2/20 0.42
BLM P54132 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42
TUBB3 Q13509 1/20 0.42
TUBB2A Q13885 1/20 0.42
TUBB8 Q3ZCM7 1/20 0.42
TUBA3E Q6PEY2 1/20 0.42
TUBA1A Q71U36 1/20 0.42
TUBA1C Q9BQE3 1/20 0.42
TUBB6 Q9BUF5 1/20 0.42
TUBB2B Q9BVA1 1/20 0.42

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
SCHEMBL9957174 0.87 TUBB4A (0.46) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL9957928 0.87 KDM4E (0.46) KDM4EALDH1A1KMT2AL3MBTL1HPGD
SCHEMBL9958678 0.86 CYP1A2 (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3327023 0.83 MAPK1 (0.58) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL9958216 0.83 CA12 (0.44) TSHRHSD17B10MAOBNFE2L2LMNA
SCHEMBL11249189 0.81 PTPN1 (0.57) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL29048095 0.80 MAPK1 (0.54) MAPK1PTPN1KDM4EALDH1A1BLM
SCHEMBL9957520 0.79 NFE2L2 (0.43) KDM4EALDH1A1KMT2AHPGDHSD17B10
SCHEMBL9957050 0.76 HSD17B10 (0.41) PTPN1KDM4EGAAMAPTKMT2A
SCHEMBL9958029 0.75 SMN1; SMN2 (0.44) MAPK1KDM4EALDH1A1MAPTHPGD

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
US-9029024-B2 Nonaqueous electrolyte solution and electrochemical element using same UBE INDUSTRIES, LTD. (JP) 2015-05-12 US disclosed
EP-2469638-B1 NON-AQUEOUS ELECTROLYTIC SOLUTION AND ELECTROCHEMICAL DEVICE USING THE SAME UBE INDUSTRIES (JP) 2014-10-01 EP disclosed
US-20120189919-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME UBE INDUSTRIES, LTD. (JP) 2012-07-26 US disclosed
WO-2012088266-A2 SUBSTITUTED IMIDAZOPYRIDAZINES AND BENZIMIDAZOLES AS INHIBITORS OF FGFR3 INCYTE CORPORATION (US) 2012-06-28 WO disclosed
EP-2469638-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ube Industries, Ltd. (JP) 2012-06-27 EP disclosed