SCHEMBL8921083

SCHEMBL8921083

CCCCCCCCCCCCCCCC=Cc1cccc2c1C(=O)OC2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.41
CYSLTR1 Q9Y271 2/20 0.41
POLM Q9NP87 1/20 0.40
POLK Q9UBT6 1/20 0.40
POLL Q9UGP5 1/20 0.40
POLH Q9Y253 1/20 0.40
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
CDC25C P30307 1/20 0.39
SLC37A4 O43826 1/20 0.39
TRPA1 O75762 1/20 0.37
MGLL Q99685 1/20 0.36
PDE5A O76074 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
MMP2 P08253 2/20 0.35
F7 P08709 2/20 0.35
F3 P13726 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 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
SCHEMBL3751427 1.00 CYSLTR2 (0.41) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL475815 1.00 CYSLTR2 (0.41) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL3751429 1.00 CYSLTR2 (0.41) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL31415615 1.00 CYSLTR2 (0.41) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL4603785 1.00 CYSLTR2 (0.41) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL8922327 1.00 CYSLTR2 (0.41) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL8918807 1.00 CYSLTR2 (0.41) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL6410029 0.85 HIF1A (0.36) CYSLTR2CYSLTR1POLMPOLKPOLL
SCHEMBL6413047 0.82 ALDH1A1 (0.41) SLC37A4TRPA1ALDH1A1TSHRKDM4E
SCHEMBL6413053 0.82 ALDH1A1 (0.41) SLC37A4TRPA1ALDH1A1TSHRKDM4E

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
US-5668244-A UNSATURATED EPOXIDES TOYO INK MANUFACTURING CO., LTD. (JP) 1997-09-16 US disclosed
EP-0687698-A2 Liquid polyester TOYO INK MANUFACTURING CO., LTD. (JP) 1995-12-20 EP disclosed