SCHEMBL9342184

SCHEMBL9342184

CCCc1cc(C=CC(=S)c2ccc(CC)cc2)cc(CCC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ PTGS2 P35354 4/20 0.39
▸ PTGS1 P23219 2/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAOB P27338 2/20 0.38
▸ MAOA P21397 2/20 0.38
▸ THRB P10828 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MITF O75030 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ KLF5 Q13887 1/20 0.36
▸ AKR1C3 P42330 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PLK1 P53350 1/20 0.34

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
SCHEMBL9342270 0.91 SMN1; SMN2 (0.46) SMN1; SMN2PTGS2PTGS1ALOX5LMNA
SCHEMBL9341575 0.88 MAOB (0.46) SMN1; SMN2PTGS2PTGS1ALOX5LMNA
SCHEMBL9338680 0.87 HDAC4 (0.39) SMN1; SMN2PTGS2PTGS1LMNAMAOB
SCHEMBL9339818 0.85 MAOA (0.38) SMN1; SMN2PTGS2PTGS1ALOX5LMNA
SCHEMBL10498768 0.83 THRA (0.47) PTGS2PTGS1LMNATHRBALDH1A1
SCHEMBL9342014 0.82 MAOB (0.51) SMN1; SMN2PTGS2PTGS1ALOX5LMNA
SCHEMBL9342426 0.82 PTGS2 (0.44) SMN1; SMN2PTGS2PTGS1ALOX5LMNA
SCHEMBL9337818 0.81 HDAC4 (0.45) SMN1; SMN2PTGS2PTGS1ALOX5LMNA
SCHEMBL9341440 0.81 SMN1; SMN2 (0.46) SMN1; SMN2PTGS2PTGS1ALOX5LMNA
SCHEMBL9338139 0.80 HDAC4 (0.47) SMN1; SMN2PTGS2THRBALDH1A1

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-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
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