SCHEMBL16905633

SCHEMBL16905633

c1ccc2c(c1)sc1nc(-n3c4ccccc4c4ccccc43)nc(-n3c4ccccc4c4ccccc43)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.39
▸ GPR55 Q9Y2T6 1/20 0.35
▸ ADK P55263 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ GPR3 P46089 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31

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
SCHEMBL19163327 0.87 ELANE (0.32) ELANEADK
SCHEMBL19163319 0.87 ELANE (0.32) ELANEADK
SCHEMBL18853453 0.86 ELANE (0.32) ELANEKDM4EL3MBTL1ATM
SCHEMBL19162843 0.84 ELANE (0.32) ELANEADK
SCHEMBL19162017 0.84 ELANE (0.32) ELANEADK
SCHEMBL19170141 0.84 ELANE (0.39) ELANEGPR55ADKKDM4EL3MBTL1
SCHEMBL19169218 0.84 GPR55 (0.48) ELANEGPR55ADKKDM4EL3MBTL1
SCHEMBL18853455 0.83 ELANE (0.32) ELANEKDM4EL3MBTL1ATM
SCHEMBL22652264 0.83 ELANE (0.34) ELANE
SCHEMBL16905742 0.82 KDM4E (0.35) ELANEADKKDM4EL3MBTL1ATM

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
WO-2015105315-A1 FUSED-RING COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 삼성에스디아이 주식회사 2015-07-16 — — WO disclosed
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