SCHEMBL30608267

SCHEMBL30608267

COc1cccc(C(=O)c2oc3ccccc3c2C)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.61
▸ RXFP1 Q9HBX9 2/20 0.58
▸ MEN1 O00255 6/20 0.58
▸ KMT2A Q03164 6/20 0.58
▸ HSD17B10 Q99714 5/20 0.58
▸ HPGD P15428 4/20 0.58
▸ TSHR P16473 4/20 0.58
▸ MAPK10 P53779 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.58
▸ KDM4E B2RXH2 7/20 0.56
▸ SMN1; SMN2 Q16637 6/20 0.56
▸ ALDH1A1 P00352 5/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ TUBB4A P04350 1/20 0.56
▸ TUBB P07437 1/20 0.56
▸ TUBA3C P0DPH7 1/20 0.56
▸ TUBA1B P68363 1/20 0.56
▸ TUBA4A P68366 1/20 0.56
▸ TUBB4B P68371 1/20 0.56

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
SCHEMBL16794986 0.86 MAPT (0.74) MAPTRXFP1MEN1KMT2AHSD17B10
SCHEMBL11823964 0.85 MAPT (0.73) MAPTRXFP1MEN1KMT2AHSD17B10
SCHEMBL30608274 0.83 KDM4E (0.72) MAPTMEN1KMT2AHSD17B10HPGD
SCHEMBL716903 0.83 RAB9A (0.74) MAPTMEN1KMT2AHSD17B10HPGD
Acetic Acid SCHEMBL5511893 0.82 MAPT (0.68) MAPTRXFP1MEN1KMT2AHSD17B10
SCHEMBL30608270 0.81 NPC1 (0.66) MAPTRXFP1MEN1KMT2AHPGD
SCHEMBL1287971 0.77 CYP2C19 (0.67) MAPTMEN1KMT2AHSD17B10HPGD
SCHEMBL11673894 0.77 L3MBTL1 (0.69) MAPTMEN1KMT2AHSD17B10HPGD
SCHEMBL30608268 0.76 NPC1 (0.73) MAPTRXFP1MEN1KMT2AHSD17B10
SCHEMBL11823271 0.75 EYA3 (0.66) MAPTMEN1KMT2AHPGDTSHR

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-116874452-B Synthesis method for synthesizing 3-methylbenzofuran structural compound by taking calcium carbide as alkynyl source 宁夏大学 2025-04-01 — — CN disclosed
CN-116874452-A Synthesis method for synthesizing 2-methylbenzofuran structural compound by taking calcium carbide as alkynyl source 宁夏大学 2023-10-13 — — CN disclosed
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