SCHEMBL22422802

SCHEMBL22422802

C/C=C(\C=C/CC)Nc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ MEN1 O00255 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NOX1 Q9Y5S8 2/20 0.39
▸ TAS2R38 P59533 1/20 0.39
▸ NAPRT Q6XQN6 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ SOAT2 O75908 1/20 0.39
▸ SOAT1 P35610 1/20 0.39
▸ HPGD P15428 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ TP53 P04637 1/20 0.38
▸ EPHX1 P07099 1/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL22591643 0.82 MAOB (0.47) KMT2AMAPTGAAMEN1NPC1
SCHEMBL19450424 0.81 TGM2 (0.42) KMT2AMAPTGAAMEN1NPC1
SCHEMBL18473251 0.80 GAA (0.45) KMT2AMAPTGAAMEN1NPC1
SCHEMBL10470698 0.78 MAPT (0.53) KMT2AMAPTGAAMEN1NPC1
SCHEMBL10817250 0.78 MMP1 (0.58) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL10470699 0.78 MAPT (0.53) KMT2AMAPTGAAMEN1NPC1
SCHEMBL19335456 0.77 NPC1 (0.35) KMT2AGAAMEN1NPC1RAB9A
SCHEMBL25839247 0.76 KMT2A (0.39) KMT2AMAPTGAAMEN1NPC1
SCHEMBL19176338 0.76 MAOB (0.42) KMT2AMAPTGAAMEN1NPC1
SCHEMBL23543675 0.75 ALDH1A1 (0.41) KMT2AMAPTMEN1NPC1RAB9A

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-3709375-A1 COMPOUND HAVING INDENOCARBAZOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2020-09-16 — — EP disclosed
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