SCHEMBL1313086

SCHEMBL1313086

CC(=CNCC1CCC2OC2C1)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.31
PTPN1 P18031 1/20 0.31
PPP1CC P36873 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
PMP22 Q01453 1/20 0.31
TFPI2 P48307 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
THPO P40225 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
SCHEMBL308952 0.77 CD81 (0.33) PPM1BPTPN1PPP1CCKDM4EGMNN
SCHEMBL4143127 0.76 KDM4E (0.32) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL53621 0.75 CD81 (0.38) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL2019678 0.75 CD81 (0.38) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL4143125 0.74 TDP1 (0.35) PPM1BPTPN1PPP1CCKDM4EGMNN
SCHEMBL6905371 0.70 ALOX15 (0.35)
SCHEMBL28259155 0.69 ALDH1A1 (0.37) TP53
SCHEMBL28496654 0.69 KDM4E (0.34) PPM1BPTPN1PPP1CCKDM4EGMNN
Methacrylic Acid SCHEMBL28059883 0.69 TFPI2 (0.34) PPM1BPTPN1PPP1CCKDM4EGMNN
SCHEMBL28586943 0.69 KDM4E (0.34) PPM1BPTPN1PPP1CCKDM4EGMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110274908-A1 FIBER COMPOSITE MITSUBISHI CHEMICAL CORPORATION (JP) 2011-11-10 US disclosed
US-8012573-B2 Fiber composite MITSUBISHI CHEMICAL CORPORATION (JP) 2011-09-06 US disclosed
US-20100272980-A1 FIBER COMPOSITE MITSUBISHI CHEMICAL CORPORATION (JP) 2010-10-28 US disclosed