SCHEMBL28400804

SCHEMBL28400804

Cc1ccc(P(=O)(c2ccc(C)cc2)n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 2/20 0.43
▸ PTPN5 P54829 1/20 0.40
▸ TSPO P30536 1/20 0.38
▸ SLC2A1 P11166 1/20 0.36
▸ ALDH1A3 P47895 1/20 0.36
▸ HPRT1 P00492 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ HPGD P15428 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ FABP1 P07148 1/20 0.35
▸ P2RY14 Q15391 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ GAA P10253 1/20 0.35

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
SCHEMBL28889116 0.89 NR4A2 (0.41) NR4A2TSPOHTR6
SCHEMBL28401361 0.79 MAPT (0.46) HPGDNPC1POLBSMN1; SMN2L3MBTL1
SCHEMBL22146607 0.76 KDM4E (0.41) NR4A2TSPOL3MBTL1KMT2A
SCHEMBL26023321 0.74 HDAC8 (0.37) PTPN5TSPOHPGDL3MBTL1HTR6
SCHEMBL17287214 0.73 AGTR1 (0.55) SMN1; SMN2L3MBTL1GAAHTR6
SCHEMBL23911726 0.73 NR4A2 (0.32) NR4A2TSPO
SCHEMBL9917163 0.73 KDM4E (0.47) NR4A2TSPOFLT3HPGDNPC1
SCHEMBL2607434 0.73 CYP2C9 (0.44) NR4A2TSPOFLT3HPGDPOLB
SCHEMBL15887268 0.73 KDM4E (0.47) NR4A2TSPOFLT3HPGDNPC1
SCHEMBL801152 0.73 PTPN5 (0.39) NR4A2PTPN5HPGDPOLBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111206262-B Synthesis method of N-phosphino-substituted carbazole and indole derivatives 新疆大学 2021-12-07 — — CN disclosed
CN-111206262-A Synthesis method of N-phosphino-substituted carbazole and indole derivatives 新疆大学 2020-05-29 — — CN disclosed
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