SCHEMBL9338134

SCHEMBL9338134

CCCCc1cccc(/C=C/C(=O)c2ccc(SCC)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.49
▸ MEF2D Q14814 1/20 0.49
▸ P4HB P07237 4/20 0.46
▸ MAOB P27338 3/20 0.43
▸ MAOA P21397 1/20 0.43
▸ BCHE P06276 2/20 0.43
▸ TUBB4A P04350 2/20 0.42
▸ TUBB P07437 2/20 0.42
▸ TUBA3C P0DPH7 2/20 0.42
▸ TUBA1B P68363 2/20 0.42
▸ TUBA4A P68366 2/20 0.42
▸ TUBB4B P68371 2/20 0.42
▸ TUBB3 Q13509 2/20 0.42
▸ TUBB2A Q13885 2/20 0.42
▸ TUBB8 Q3ZCM7 2/20 0.42
▸ TUBA3E Q6PEY2 2/20 0.42
▸ TUBA1A Q71U36 2/20 0.42
▸ TUBA1C Q9BQE3 2/20 0.42
▸ TUBB6 Q9BUF5 2/20 0.42
▸ TUBB2B Q9BVA1 2/20 0.42

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
SCHEMBL9338145 1.00 HDAC4 (0.49) HDAC4MEF2DP4HBMAOBMAOA
SCHEMBL9339730 0.97 P4HB (0.47) HDAC4MEF2DP4HBTUBB4ATUBB
SCHEMBL9339741 0.97 P4HB (0.47) HDAC4MEF2DP4HBTUBB4ATUBB
SCHEMBL9342508 0.95 THRA (0.49) HDAC4MEF2DP4HBTUBB4ATUBB
SCHEMBL9342514 0.95 THRA (0.49) HDAC4MEF2DP4HBTUBB4ATUBB
SCHEMBL9338688 0.93 MAOB (0.45) P4HBMAOBMAOABCHE
SCHEMBL9338674 0.93 MAOB (0.45) P4HBMAOBMAOABCHE
SCHEMBL10498328 0.90 HDAC4 (0.47) HDAC4MEF2DP4HBTUBB4ATUBB
SCHEMBL10498321 0.90 HDAC4 (0.47) HDAC4MEF2DP4HBTUBB4ATUBB
SCHEMBL9337829 0.88 P4HB (0.47) HDAC4MEF2DP4HBMAOBMAOA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 — — EP disclosed
US-5045239-A Chalcone derivative NIPPON OIL AND FATS CO., LTD. (JP) 1991-09-03 — — US disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
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