SCHEMBL19679700

SCHEMBL19679700

c1ccc2c(c1)oc1cc3c(cc12)oc1nc(-n2c4ccccc4c4ccccc42)nc(-n2c4ccccc4c4ccccc42)c13

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.37
▸ SMN1; SMN2 Q16637 6/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HPGD P15428 7/20 0.34
▸ ALDH1A1 P00352 6/20 0.34
▸ MEN1 O00255 5/20 0.34
▸ KMT2A Q03164 5/20 0.34
▸ MAPT P10636 5/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ RAB9A P51151 4/20 0.34
▸ NPC1 O15118 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ POLB P06746 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ DUSP3 P51452 1/20 0.34
▸ PTPN5 P54829 1/20 0.34
▸ PTPN11 Q06124 1/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33

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
SCHEMBL16905826 0.90 SMN1; SMN2 (0.39) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL20024416 0.87 PLA2G2A (0.36) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL24746427 0.85 SMN1; SMN2 (0.36) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL19247405 0.79 TSHR (0.36) AHRSMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL19246479 0.79 SMN1; SMN2 (0.34) AHRSMN1; SMN2LMNAHPGDALDH1A1
SCHEMBL19162400 0.79 SMN1; SMN2 (0.32) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL19163040 0.79 SMN1; SMN2 (0.32) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL19163386 0.78 SMN1; SMN2 (0.32) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL19161971 0.78 SMN1; SMN2 (0.32) SMN1; SMN2LMNAHPGDALDH1A1MEN1
SCHEMBL19679749 0.78 AHR (0.37) AHRSMN1; SMN2LMNAHPGDALDH1A1

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
US-20170352447-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SFC CO., LTD. (KR) 2017-12-07 — — US disclosed
US-20170352447-A1 NOVEL HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SFC CO., LTD. (KR) 2017-12-07 — — US disclosed
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