SCHEMBL11134385

SCHEMBL11134385

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nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNPAT O15228 2/20 0.47
▸ ACE P12821 2/20 0.39
▸ MME P08473 3/20 0.38
▸ EDNRA P25101 1/20 0.38
▸ CASP3 P42574 3/20 0.36
▸ CASP7 P55210 2/20 0.36
▸ TNF P01375 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGA2B P08514 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ THPO P40225 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL19051569 0.91 GNPAT (0.40) GNPATMMETNFPTPN1
SCHEMBL61371 0.90 ALOX15 (0.42) GNPATTNFITGB3ITGA2BKDM4E
SCHEMBL6026424 0.90 ALOX15 (0.42) GNPATTNFITGB3ITGA2BKDM4E
SCHEMBL61370 0.90 ALOX15 (0.42) GNPATTNFITGB3ITGA2BKDM4E
SCHEMBL19051620 0.89 GNPAT (0.44) GNPATTNFITGB3ITGA2B
SCHEMBL7162435 0.88 ALOX15 (0.41) GNPATTNFITGB3ITGA2BKDM4E
SCHEMBL7162439 0.88 ALOX15 (0.41) GNPATTNFITGB3ITGA2BKDM4E
Water SCHEMBL6933673 0.88 ALOX15 (0.41) GNPATTNFITGB3ITGA2BKDM4E
Water SCHEMBL8680771 0.88 ALOX15 (0.41) GNPATTNFITGB3ITGA2BKDM4E
SCHEMBL30632044 0.88 PTPN1 (0.39) GNPATACEMMEEDNRACASP3

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
EP-0083612-A1 NEW DERIVATIVES OF DIPEPTIDES, METHOD FOR THE PREPARATION THEREOF AND UTILIZATION THEREOF AS DRUGS FLORK, Michel (FR) 1983-07-20 — — EP disclosed
WO-1983000146-A1 NEW DERIVATIVES OF DIPEPTIDES, METHOD FOR THE PREPARATION THEREOF AND UTILIZATION THEREOF AS DRUGS FLORK, MICHEL 1983-01-20 — — WO disclosed
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