SCHEMBL9342497

SCHEMBL9342497

CCCCCCCCCCCCCCCCCCc1cccc(C=CC(=S)c2ccc(C)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.43
▸ MEF2D Q14814 1/20 0.43
▸ LPL P06858 2/20 0.43
▸ LIPG Q9Y5X9 2/20 0.43
▸ PPARA Q07869 2/20 0.41
▸ PPARG P37231 1/20 0.41
▸ TRPM2 O94759 2/20 0.41
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ PLK1 P53350 6/20 0.38
▸ PLK3 Q9H4B4 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
SCHEMBL10497777 0.93 THRA (0.46) HDAC4MEF2DLPLLIPGTHRA
SCHEMBL10498322 0.91 HDAC4 (0.47) HDAC4MEF2DLPLLIPGTHRA
SCHEMBL9342510 0.90 HDAC4 (0.43) HDAC4MEF2DLPLLIPGTHRA
SCHEMBL9339736 0.89 HDAC4 (0.44) HDAC4MEF2DLPLLIPGTHRA
SCHEMBL10498154 0.88 THRA (0.44) THRATHRB
SCHEMBL9338139 0.85 HDAC4 (0.47) HDAC4MEF2DLPLLIPGTHRA
SCHEMBL10497836 0.83 P4HB (0.47) THRATHRB
SCHEMBL10498288 0.83 SLC6A19 (0.45) THRATHRB
SCHEMBL10497663 0.82 THRA (0.43) THRATHRBPLK1PLK3
SCHEMBL10497705 0.82 THRA (0.44) THRATHRB

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 5 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 claimed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP claimed
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
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