SCHEMBL7868928

SCHEMBL7868928

Cc1cc2c(cc1Nc1ccccc1)Cc1ccc(NCCCCC(C)C)cc1-2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.34
ALDH1A1 P00352 4/20 0.33
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 2/20 0.31
CYP3A4 P08684 3/20 0.31
HSD17B10 Q99714 3/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA12 O43570 1/20 0.31
CA9 Q16790 1/20 0.31
KCNH3 Q9ULD8 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
ALOX12 P18054 1/20 0.31
MAPK1 P28482 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
SCHEMBL7868922 0.82 HSD17B10 (0.40) GAAALDH1A1MAPTCYP3A4HSD17B10
SCHEMBL29068477 0.81 GAA (0.38) GAAALDH1A1KMT2AMAPTCYP3A4
SCHEMBL30572811 0.81 GAA (0.38) GAAALDH1A1KMT2AMAPTCYP3A4
SCHEMBL30043223 0.77 CYP1A2 (0.39) GAAALDH1A1KMT2AMAPTCYP3A4
SCHEMBL7868925 0.77 CYP1A2 (0.39) GAAALDH1A1KMT2AMAPTCYP3A4
SCHEMBL30572820 0.77 CYP1A2 (0.39) GAAALDH1A1KMT2AMAPTCYP3A4
SCHEMBL30572823 0.76 CYP1A2 (0.37) GAAMAPTCYP3A4HSD17B10CYP1A2
SCHEMBL29068460 0.76 CYP1A2 (0.37) GAAMAPTCYP3A4HSD17B10CYP1A2
SCHEMBL28931292 0.75 MAPT (0.35) GAAALDH1A1KMT2AMAPTCYP3A4
SCHEMBL7869607 0.75 MEN1 (0.41) ALDH1A1KMT2AKCNH3

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-6303259-B1 FOR COLOR DUPLICATORS, COLOR PRINTERS, ETC MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 2001-10-16 US disclosed