SCHEMBL27995271

SCHEMBL27995271

CCCCCCCC(c1c[nH]nn1)C(C)CC

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
GPR84 Q9NQS5 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
SCHEMBL27995098 0.92 GPR84 (0.31) GPR84
SCHEMBL27995267 0.91 GPR84 (0.31) GPR84
SCHEMBL27617993 0.80 ZDHHC7 (0.34) PRSS1PRSS2PRSS3GPR84
SCHEMBL18647982 0.79 NR1I2 (0.33) GPR84
SCHEMBL22481049 0.79 NR1I2 (0.33) GPR84
SCHEMBL11204801 0.79 GPR84 (0.37) GPR84
SCHEMBL4364994 0.78 NR1I2 (0.36)
SCHEMBL7862559 0.76 GPR84 (0.30) GPR84
SCHEMBL9489846 0.76 SPHK1 (0.42) GPR84
SCHEMBL3021559 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104672434-A Organic semiconductor material and preparation method and application thereof UNIV SOUTH CHINA TECH 2015-06-03 CN disclosed