SCHEMBL10497360

SCHEMBL10497360

CCCCCCCCCCCCCCCCCc1ccc(C(=S)C=Cc2cccc(OC)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.48
▸ PLK1 P53350 2/20 0.46
▸ PLK3 Q9H4B4 1/20 0.46
▸ BCHE P06276 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HTT P42858 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ STAT3 P40763 1/20 0.43
▸ CYP1A1 P04798 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP1B1 Q16678 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ FOS P01100 1/20 0.43
▸ JUN P05412 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ MAOA P21397 1/20 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
SCHEMBL10497432 0.90 CYSLTR2 (0.52) BCHEALDH1A1LMNAKDM4EMEN1
SCHEMBL10499064 0.88 CYSLTR2 (0.52) BCHEALDH1A1KDM4ECYSLTR2
SCHEMBL10497836 0.87 P4HB (0.47) ALDH1A1LMNACYP1A2EGFRKDM4E
SCHEMBL10497777 0.87 THRA (0.46) CYP1A2THRATHRB
SCHEMBL10498322 0.86 HDAC4 (0.47) CYP1A2THRATHRB
SCHEMBL9339939 0.86 MAOB (0.54) MAOBBCHEALDH1A1GAAHTT
SCHEMBL9342494 0.85 CYSLTR2 (0.52) BCHEALDH1A1KDM4ETHRATHRB
SCHEMBL9338557 0.85 CYSLTR2 (0.52) BCHEALDH1A1KDM4ETHRATHRB
SCHEMBL9337916 0.85 CYSLTR2 (0.52) BCHEALDH1A1KDM4ETHRATHRB
SCHEMBL9337348 0.85 CYSLTR2 (0.52) BCHEALDH1A1KDM4ETHRATHRB

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

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