SCHEMBL27859637

SCHEMBL27859637

CCCCc1ccccc1OC(=O)CCC

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.57
THRB P10828 1/20 0.57
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
RECQL P46063 1/20 0.55
KMT2A Q03164 1/20 0.55
PPARA Q07869 2/20 0.49
PPARG P37231 1/20 0.49
POLM Q9NP87 1/20 0.44
POLK Q9UBT6 1/20 0.44
POLL Q9UGP5 1/20 0.44
POLH Q9Y253 1/20 0.44
ALOX15 P16050 1/20 0.43
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
LTB4R Q15722 1/20 0.43
LTB4R2 Q9NPC1 1/20 0.43

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
SCHEMBL9468390 0.94 KDM4E (0.59) THRATHRBKDM4EMEN1RECQL
SCHEMBL937978 0.94 KDM4E (0.59) THRATHRBKDM4EMEN1RECQL
SCHEMBL28969837 0.94 KDM4E (0.63) THRATHRBKDM4EMEN1RECQL
SCHEMBL28008694 0.92 THRA (0.59) THRATHRBKDM4EMEN1RECQL
SCHEMBL28222935 0.91 THRA (0.51) THRATHRBKDM4EMEN1RECQL
SCHEMBL28008676 0.91 THRA (0.62) THRATHRBKDM4EMEN1RECQL
SCHEMBL1789816 0.89 THRA (0.58) THRATHRBKDM4EMEN1RECQL
SCHEMBL30399402 0.89 THRA (0.58) THRATHRBKDM4EMEN1RECQL
SCHEMBL7927889 0.88 THRA (0.66) THRATHRBKDM4EMEN1RECQL
SCHEMBL10620491 0.88 THRA (0.66) THRATHRBKDM4EMEN1RECQL

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
CN-102522579-A Fuel supplies for fuel cells BIC SOC 2012-06-27 CN disclosed
CN-102522580-A Fuel supplies for fuel cells BIC SOC 2012-06-27 CN disclosed
CN-101233180-B Fuel supply device for fuel cell BIC SOC 2012-03-07 CN disclosed