SCHEMBL9064407

SCHEMBL9064407

CCc1cc(C(C)C)c(C(C)C)c(C(C)C)c1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
FABP3 P05413 1/20 0.32
FABP4 P15090 1/20 0.32
FABP5 Q01469 1/20 0.32
P2RX3 P56373 1/20 0.31
P2RX2 Q9UBL9 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL9063441 0.77 ACE2 (0.34) CA1CA2
SCHEMBL4634575 0.77 CA1 (0.39) FABP3FABP4FABP5CA1CA2
SCHEMBL21808365 0.77 HTT (0.37) TAAR1ALOX15ALOX12P2RX3P2RX2
SCHEMBL31261127 0.77 HTT (0.37) TAAR1ALOX15ALOX12P2RX3P2RX2
SCHEMBL18882776 0.76 DPP4 (0.38) TAAR1ALOX15ALOX12
SCHEMBL6269855 0.73 ALOX15 (0.37) TAAR1ALOX15ALOX12FABP3FABP4
SCHEMBL25907367 0.72
SCHEMBL9064264 0.71 GSR (0.38) CA1CA2
SCHEMBL341687 0.71 ALDH1A1 (0.35) TAAR1ALOX15ALOX12FABP3FABP4
SCHEMBL29779647 0.71 ALDH1A1 (0.35) TAAR1ALOX15ALOX12FABP3FABP4

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
EP-0708074-A1 Process for the preparation of pyromellitic anhydride MITSUBISHI OIL CO., LTD. (JP) 1996-04-24 EP disclosed