SCHEMBL8124723

SCHEMBL8124723

CCc1ccc(C=C(C#N)c2cc(OC)c(OC)cc2OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.47
▸ TUBB1 Q9H4B7 4/20 0.47
▸ TUBB4A P04350 3/20 0.47
▸ TUBB P07437 3/20 0.47
▸ TUBA3C P0DPH7 3/20 0.47
▸ TUBA1B P68363 3/20 0.47
▸ TUBA4A P68366 3/20 0.47
▸ TUBB4B P68371 3/20 0.47
▸ TUBB3 Q13509 3/20 0.47
▸ TUBB2A Q13885 3/20 0.47
▸ TUBB8 Q3ZCM7 3/20 0.47
▸ TUBA3E Q6PEY2 3/20 0.47
▸ TUBA1A Q71U36 3/20 0.47
▸ TUBA1C Q9BQE3 3/20 0.47
▸ TUBB6 Q9BUF5 3/20 0.47
▸ TUBB2B Q9BVA1 3/20 0.47

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
SCHEMBL8130453 0.85 MAPT (0.53) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL8135923 0.83 MAPT (0.52) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL28239032 0.83 MAPT (0.52) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL8122555 0.83 MEN1 (0.52) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL8124060 0.83 MEN1 (0.52) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL8116052 0.83 MAPT (0.52) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL28238026 0.83 MEN1 (0.52) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL8132637 0.83 MEN1 (0.68) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL8398768 0.83 TUBB4A (0.55) MAPTKMT2AMEN1ALDH1A1TUBB1
SCHEMBL8398771 0.83 TUBB4A (0.55) MAPTKMT2AMEN1ALDH1A1TUBB1

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
EP-0645382-B1 COUMARIN DERIVATIVE AND USE THEREOF MORINAGA MILK INDUSTRY CO LTD (JP) 2000-07-12 — — EP disclosed
EP-0645382-A1 COUMARIN DERIVATIVE AND USE THEREOF MORINAGA MILK INDUSTRY CO., LTD. (JP) 1995-03-29 — — EP disclosed
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