SCHEMBL23656367

SCHEMBL23656367

Cc1cc(-c2ccccc2)c(N2c3ccccc3N(C)C2C)c(-c2ccccc2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ GAA P10253 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ METAP2 P50579 1/20 0.34
▸ HDAC7 Q8WUI4 1/20 0.34
▸ NUDT1 P36639 1/20 0.33
▸ GPR3 P46089 1/20 0.33
▸ MET P08581 1/20 0.32
▸ PSMB5 P28074 1/20 0.31
▸ PTPN2 P17706 1/20 0.31
▸ PTPN1 P18031 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MAOB P27338 3/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ ESR2 Q92731 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
SCHEMBL23656228 0.86 KDM4E (0.41) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL16420323 0.77 KDM4E (0.40) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL24596461 0.73 KDM4E (0.37) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL12393018 0.73 ALDH1A1 (0.34) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL12393019 0.73 BRD4 (0.37) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL24398363 0.71 GAA (0.44) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL11941264 0.71 GAA (0.44) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL16711487 0.71 GAA (0.44) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL16420314 0.71 KDM4E (0.35) ALDH1A1HPGDGAAKDM4EALOX12
SCHEMBL17131424 0.71 KDM4E (0.35) ALDH1A1HPGDGAAKDM4EALOX12

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-3851443-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2021-07-21 — — EP disclosed
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