SCHEMBL9778908

SCHEMBL9778908

Cc1ccc(C(=S)C=Cc2ccc(I)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.51
▸ MAOB P27338 6/20 0.46
▸ MAOA P21397 4/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP1B1 Q16678 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ CYP1A1 P04798 1/20 0.42
▸ FOS P01100 1/20 0.41
▸ JUN P05412 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ EGFR P00533 2/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ APP P05067 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
SCHEMBL10337730 0.91 MAPT (0.60) MAPTMAOBMAOARAB9APOLB
SCHEMBL9338507 0.89 APP (0.48) MAPTMAOBMAOARAB9APOLB
SCHEMBL9337744 0.85 MAPT (0.42) MAPTMAOBMAOARAB9APOLB
SCHEMBL9338179 0.84 MAPT (0.65) MAPTMAOBMAOARAB9APOLB
SCHEMBL11823920 0.83 MAOB (0.66) MAPTMAOBMAOARAB9APOLB
SCHEMBL9338058 0.83 MAOB (0.66) MAPTMAOBMAOARAB9APOLB
SCHEMBL9341603 0.83 NFE2L2 (0.60) MAPTMAOBMAOARAB9APOLB
SCHEMBL9338517 0.83 GPR183 (0.52) MAPTMAOBMAOARAB9APOLB
SCHEMBL9341640 0.82 MAPT (0.64) MAPTMAOBMAOARAB9APOLB
SCHEMBL9338542 0.82 CYP1B1 (0.64) MAPTMAOBMAOARAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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