SCHEMBL7501448

SCHEMBL7501448

[CH2]CCCCCc1cc(Cl)cc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.37
TSHR P16473 1/20 0.36
DAO P14920 1/20 0.35
CNR1 P21554 1/20 0.35
IGF1R P08069 1/20 0.34
ALOX15 P16050 1/20 0.34
PTGS2 P35354 3/20 0.33
HTR3E A5X5Y0 2/20 0.32
HTR3B O95264 2/20 0.32
HTR3A P46098 2/20 0.32
HTR3D Q70Z44 2/20 0.32
HTR3C Q8WXA8 2/20 0.32
DBH P09172 1/20 0.32
CBS P35520 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP3A4 P08684 1/20 0.30

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
SCHEMBL5980741 0.98 TSHR (0.38) IDO1TSHRDAOCNR1IGF1R
SCHEMBL5979805 0.91 TSHR (0.40) IDO1TSHRDAOCNR1IGF1R
SCHEMBL5980005 0.80 TSHR (0.44) IDO1TSHRDAOCNR1HTR3E
SCHEMBL8861076 0.80 IGF1R (0.36) IGF1RALOX15PTGS2CBSCYP3A4
SCHEMBL1047871 0.79 HTR3E (0.56) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL15352069 0.77 IGF1R (0.52) IDO1IGF1RALOX15HTR3EHTR3B
SCHEMBL11146715 0.77 IGF1R (0.52) IDO1IGF1RALOX15HTR3EHTR3B
SCHEMBL3890912 0.77 IGF1R (0.52) IDO1IGF1RALOX15HTR3EHTR3B
SCHEMBL9653036 0.77 IGF1R (0.52) IDO1IGF1RALOX15HTR3EHTR3B
SCHEMBL11353612 0.77 IGF1R (0.52) IDO1IGF1RALOX15HTR3EHTR3B

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-0638075-B1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMA CO LTD (JP) 2002-01-16 EP disclosed
US-5677322-A THERAPY FOR AGING, DIABETES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US disclosed
EP-0638075-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-15 EP disclosed
WO-1994019335-A1 THIAZOLE OR IMIDAZOLE DERIVATIVES AS MAILLARD REACTION INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed