SCHEMBL9339925

SCHEMBL9339925

CCc1ccc(C(=S)C=Cc2cccc(N(C)C)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 2/20 0.41
▸ MEF2D Q14814 2/20 0.41
▸ NR1H4 Q96RI1 4/20 0.39
▸ MAPT P10636 3/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ CYP1B1 Q16678 1/20 0.39
▸ SENP8 Q96LD8 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ LMNA P02545 2/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.37
▸ MEN1 O00255 1/20 0.37

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
SCHEMBL9338368 0.88 LMNA (0.43) HDAC4MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL9342218 0.85 MAPT (0.41) HDAC4MEF2DNR1H4MAPTNPC1
SCHEMBL9337818 0.85 HDAC4 (0.45) HDAC4MEF2DMAPTNPC1RAB9A
SCHEMBL9779017 0.82 MAOB (0.48) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL9338665 0.82 SLC6A19 (0.51) MAPTSMN1; SMN2KMT2ACYP1B1ALDH1A1
SCHEMBL9338586 0.81 NPSR1 (0.48) HDAC4MEF2DMAPTNPC1RAB9A
SCHEMBL9338406 0.80 BCL2 (0.43) MAPTNPC1RAB9ASMN1; SMN2CASP3
SCHEMBL9338680 0.80 HDAC4 (0.39) HDAC4MEF2DMAPTNPC1RAB9A
SCHEMBL9339939 0.79 MAOB (0.54) KMT2ACYP1B1ALDH1A1LMNAMEN1
SCHEMBL9338013 0.79 PTGS2 (0.44) HDAC4MEF2DMAPTNPC1RAB9A

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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