SCHEMBL22804253

SCHEMBL22804253

Nc1ccc(-c2ccc(Nc3ccc(-c4cccc5ccccc45)cc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.51
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA9 Q16790 3/20 0.51
CYP3A4 P08684 3/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPT P10636 3/20 0.50
PRKCZ Q05513 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
ALOX12 P18054 1/20 0.50
CYP2C19 P33261 1/20 0.50
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
KDM1A O60341 2/20 0.46
PPARG P37231 4/20 0.41
PPARA Q07869 4/20 0.41
ENPP3 O14638 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
SCHEMBL23232067 0.91 CA12 (0.54) CA12CA1CA2CA9CYP3A4
SCHEMBL30800492 0.91 CA12 (0.54) CA12CA1CA2CA9CYP3A4
SCHEMBL2008772 0.89 CA12 (0.61) CA12CA1CA2CA9CYP3A4
SCHEMBL29632988 0.89 CA12 (0.61) CA12CA1CA2CA9CYP3A4
SCHEMBL29405564 0.89 HDAC8 (0.54) CA12CA1CA2CA9CYP3A4
SCHEMBL10136271 0.89 HDAC8 (0.54) CA12CA1CA2CA9CYP3A4
SCHEMBL22579723 0.88 CA12 (0.51) CA12CA1CA2CA9CYP3A4
SCHEMBL10136282 0.88 HSD17B10 (0.53) CA12CA1CA2CA9CYP3A4
SCHEMBL29772984 0.88 CA12 (0.51) CA12CA1CA2CA9CYP3A4
SCHEMBL29407327 0.88 CA12 (0.51) CA12CA1CA2CA9CYP3A4

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924205-A Organic electroluminescent compound, organic electroluminescent material containing double bodies and organic electroluminescent device 吉林奥来德光电材料股份有限公司 2024-04-26 CN disclosed
CN-111646997-B Nitrogen-containing heterocyclic compound, electronic element, and electronic device 陕西莱特光电材料股份有限公司 2021-11-12 CN disclosed
CN-111875505-B Nitrogen-containing compound, organic electroluminescent device, and electronic device 陕西莱特光电材料股份有限公司 2021-10-08 CN disclosed
WO-2021120835-A1 NITROGEN-CONTAINING COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE, AND ELECTRONIC APPARATUS 陕西莱特光电材料股份有限公司 2021-06-24 WO disclosed
WO-2020253445-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 陕西莱特光电材料股份有限公司 2020-12-24 WO disclosed
CN-111875505-A Nitrogen-containing compound, organic electroluminescent device, and electronic device 陕西莱特光电材料股份有限公司 2020-11-03 CN disclosed
CN-111004242-B Nitrogen-containing compound, electronic component, and electronic device 陕西莱特光电材料股份有限公司 2020-10-27 CN disclosed
CN-111646997-A Nitrogen-containing heterocyclic compound, electronic element, and electronic device 陕西莱特光电材料股份有限公司 2020-09-11 CN disclosed
CN-110183333-B Organic electroluminescent material and organic electroluminescent device containing same 陕西莱特光电材料股份有限公司 2020-06-30 CN disclosed
CN-111004242-A Nitrogen-containing compound, electronic component, and electronic device 陕西莱特光电材料股份有限公司 2020-04-14 CN disclosed