SCHEMBL18485441

SCHEMBL18485441

C=CCOC(=O)N1C(=O)C2CCCCC2C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
TP53 P04637 1/20 0.39
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
CYP3A4 P08684 1/20 0.38
PPOX P50336 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
FAAH O00519 3/20 0.34
POLB P06746 1/20 0.34
CHRM1 P11229 1/20 0.34
MGLL Q99685 1/20 0.34
MAPT P10636 2/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ELANE P08246 1/20 0.33
CTSG P08311 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 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
SCHEMBL18485435 0.83 TSHR (0.37) ALDH1A1CYP3A4NPSR1FAAHPOLB
SCHEMBL6930133 0.83 TSHR (0.37) ALDH1A1CYP3A4NPSR1FAAHPOLB
SCHEMBL18485421 0.80 KMT2A (0.45) HTTTP53ALDH1A1PPOXPOLB
SCHEMBL18485427 0.75 HTT (0.41) HTTTP53ALDH1A1PPOXPOLB
SCHEMBL18485419 0.74 CYP3A4 (0.39) ALDH1A1CYP3A4NPSR1FAAHCHRM1
SCHEMBL28108459 0.73 FAAH (0.33) GAACYP3A4NPSR1FAAHCHRM1
SCHEMBL18485453 0.72 LMNA (0.42) HTTTP53ALDH1A1TSHRNPC1
SCHEMBL8521913 0.70 CYP3A4 (0.43) ALDH1A1CYP3A4NPSR1MAPTTSHR
SCHEMBL14458907 0.69 ALDH1A1 (0.38) ALDH1A1GAACYP3A4NPSR1CHRM1
SCHEMBL23812541 0.68 NPSR1 (0.40) ALDH1A1CYP3A4NPSR1FAAHCHRM1

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-20170117588-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2017-04-27 US disclosed
US-20170117588-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2017-04-27 US disclosed
US-20170117588-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2017-04-27 US disclosed
EP-3131153-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE Sumitomo Seika Chemicals Co., Ltd. (JP) 2017-02-15 EP disclosed
EP-3131153-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE Sumitomo Seika Chemicals Co., Ltd. (JP) 2017-02-15 EP disclosed