SCHEMBL9517857

SCHEMBL9517857

CCc1ccccc1-c1ccccc1.Cc1ccccc1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.46
▸ PPARA Q07869 1/20 0.46
▸ DPP4 P27487 1/20 0.44
▸ PDCD1 Q15116 1/20 0.43
▸ CD274 Q9NZQ7 1/20 0.43
▸ HTR7 P34969 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ FOLH1 Q04609 1/20 0.41
▸ SCN8A Q9UQD0 1/20 0.40
▸ BRS3 P32247 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ PTGS1 P23219 1/20 0.39

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
SCHEMBL11197020 0.83 DPP4 (0.52) DPP4PDCD1CD274HTR7KMT2A
SCHEMBL328862 0.83 DPP4 (0.60) PPARGPPARADPP4PDCD1CD274
SCHEMBL31261742 0.83 DPP4 (0.60) PPARGPPARADPP4PDCD1CD274
SCHEMBL10824453 0.81 TP53 (0.48) PPARGPPARAL3MBTL1TP53
Biphenyl SCHEMBL15329765 0.81 DPP4 (0.58) PPARGPPARADPP4PDCD1CD274
SCHEMBL340250 0.81 DPP4 (0.58) DPP4PDCD1CD274HTR7KMT2A
Ethane SCHEMBL3681665 0.81 DPP4 (0.58) PPARGPPARADPP4PDCD1CD274
Water SCHEMBL9719797 0.81 DPP4 (0.58) PPARGPPARADPP4PDCD1CD274
Hydrogen Sulfide SCHEMBL27801071 0.81 DPP4 (0.58) PPARGPPARADPP4PDCD1CD274
SCHEMBL31070319 0.81 DPP4 (0.58) DPP4PDCD1CD274HTR7KMT2A

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-0384818-B1 COMPOSITIONS BASED ON POLYPHENYL METHANES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DIELECTRICUMS ELF ATOCHEM S.A. (FR) 1993-09-01 — — EP disclosed
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