Sugi Predict

Sugi Predict / Compounds / SCHEMBL12414930

SCHEMBL12414930

SCHEMBL12414930

CCCCCN1/C(=C/C=C2\CCCC(/C=C/C3=[N+](CCCCC)c4ccc(I)cc4C3(C)C)=C2Sc2nnnn2-c2ccccc2)C(C)(C)c2cc(I)ccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FOLR1 P15328 6/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ PRMT1 Q99873 7/20 0.40
▸ PRMT5 O14744 2/20 0.39
▸ PRMT8 Q9NR22 2/20 0.39
▸ CARM1 Q86X55 1/20 0.39
▸ FOLH1 Q04609 4/20 0.39
▸ PTPN1 P18031 1/20 0.38
▸ TLR2 O60603 1/20 0.32

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
SCHEMBL12414856 0.97 PRMT1 (0.41) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12414931 0.95 FOLR1 (0.47) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL18256965 0.95 FOLR1 (0.42) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12414927 0.92 PTPN1 (0.46) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12415035 0.90 PRMT1 (0.49) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12414859 0.90 PRMT1 (0.49) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12414923 0.88 FOLR1 (0.47) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12415019 0.87 PRMT1 (0.46) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12980822 0.87 PRMT1 (0.46) FOLR1HTR1APRMT1PRMT5PRMT8
SCHEMBL12414924 0.85 PTPN1 (0.46) FOLR1HTR1APRMT1PRMT5PRMT8

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
US-20110165518-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2011-07-07 — — US disclosed