SCHEMBL10044314

SCHEMBL10044314

Cc1cc2c(cc1Nc1ccccc1)-c1ccccc1C2(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.42
▸ EGFR P00533 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ MAPT P10636 4/20 0.41
▸ SRC P12931 3/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ GLA P06280 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ RGS12 O14924 1/20 0.41
▸ GMNN O75496 1/20 0.41
▸ PRKD3 O94806 1/20 0.41
▸ PRKCG P05129 1/20 0.41

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
SCHEMBL23040346 0.94 GAA (0.42) GAAEGFRALDH1A1KDM4EMAPT
SCHEMBL30318897 0.89 SIRT2 (0.39) GAAEGFRALDH1A1KDM4EMAPT
SCHEMBL23040349 0.89 SIRT2 (0.39) GAAEGFRALDH1A1KDM4EMAPT
SCHEMBL26900008 0.86 PTGER4 (0.39) GAAEGFRALDH1A1KDM4EMAPT
SCHEMBL20751938 0.83 PDK2 (0.35) EGFRKDM4EMAPTTDP1MEN1
SCHEMBL23065289 0.82 BRD4 (0.32) MAPTPDK2BRD4
SCHEMBL23040350 0.82 PDK2 (0.36) GAAALDH1A1KDM4EMAPTHPGD
SCHEMBL23040345 0.81 ACLY (0.36) ALDH1A1MAPTNPSR1LMNASMN1; SMN2
SCHEMBL18383402 0.81 CYP3A4 (0.39) GAAEGFRALDH1A1KDM4EMAPT
SCHEMBL30714373 0.81 MEN1 (0.37) GAAEGFRALDH1A1KDM4EMAPT

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-2415773-A2 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL Duksan Hi-Metal Co., Ltd. (KR) 2012-02-08 — — EP disclosed
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