SCHEMBL2595252

SCHEMBL2595252

Fc1cccc(-c2cccc(OC3CC3)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.55
SLC6A3 Q01959 4/20 0.55
SLC6A4 P31645 3/20 0.55
TAAR1 Q96RJ0 2/20 0.47
ENPP2 Q13822 1/20 0.46
DHODH Q02127 3/20 0.44
ESR2 Q92731 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL7235082 0.89 SLC6A2 (0.67) SLC6A2SLC6A3SLC6A4SMN1; SMN2
SCHEMBL28054784 0.85 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4ENPP2DHODH
SCHEMBL1075662 0.83 SLC6A4 (0.83) SLC6A2SLC6A3SLC6A4
SCHEMBL1075663 0.83 SLC6A4 (0.83) SLC6A2SLC6A3SLC6A4
SCHEMBL23099877 0.81 SLC6A2 (0.63) SLC6A2SLC6A3SLC6A4SMN1; SMN2
SCHEMBL18997019 0.81 SLC6A2 (0.63) SLC6A2SLC6A3SLC6A4FFAR4SMN1; SMN2
SCHEMBL16569940 0.81 SLC6A2 (0.58) SLC6A2SLC6A3SLC6A4SMN1; SMN2
SCHEMBL18186076 0.81 SLC6A2 (0.58) SLC6A2SLC6A3SLC6A4SMN1; SMN2
SCHEMBL1337675 0.80 DHODH (0.49) SLC6A2SLC6A3SLC6A4ENPP2DHODH
SCHEMBL1337890 0.79 DHODH (0.46) SLC6A2SLC6A3SLC6A4TAAR1ENPP2

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
EP-2566847-A1 NOVEL IMMUNOMODULATOR AND ANTI INFLAMMATORY COMPOUNDS Icozen Therapeutics Pvt. Ltd. (IN) 2013-03-13 EP disclosed
WO-2011138665-A1 NOVEL IMMUNOMODULATOR AND ANTI INFLAMMATORY COMPOUNDS INCOZEN THERAPEUTICS PVT. LTD. (IN) 2011-11-10 WO disclosed