SCHEMBL10458467

SCHEMBL10458467

CCCCCCC(C)C(=O)C(CCCC)CC(Cc1ccccc1-c1ccccc1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
MME P08473 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
PPARA Q07869 1/20 0.41
PTGES O14684 2/20 0.41
ALOX5 P09917 2/20 0.41
PPARG P37231 2/20 0.41
FOLH1 Q04609 1/20 0.40
SOAT1 P35610 2/20 0.39
GRIK1 P39086 1/20 0.39
GRIK2 Q13002 1/20 0.39
MMP2 P08253 8/20 0.38
MMP3 P08254 3/20 0.38
MMP1 P03956 2/20 0.38
PTGER1 P34995 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER3 P43115 1/20 0.38
PTGER2 P43116 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
SCHEMBL9325691 0.87 KMT2A (0.56) KMT2AMMEACECPA1ACE2
SCHEMBL9327562 0.82 MMP2 (0.45) KMT2AMMEACECPA1ACE2
SCHEMBL1582615 0.73 KMT2A (0.67) KMT2AMMEACECPA1ACE2
SCHEMBL6724651 0.73 KMT2A (0.71) KMT2AMMEACECPA1ACE2
Hydrochloric Acid SCHEMBL6721519 0.72 KMT2A (0.69) KMT2AMMEACECPA1ACE2
Biphenyl SCHEMBL9325687 0.72 ACE2 (0.61) ACE2
SCHEMBL10456833 0.72 KMT2A (0.52) KMT2AMMEACECPA1ACE2
SCHEMBL6721538 0.72 KMT2A (0.59) KMT2AMMEACECPA1ACE2
SCHEMBL8491352 0.71 FOLH1 (0.58) CPA1PTGESALOX5PPARGFOLH1
SCHEMBL28807900 0.71 FOLH1 (0.52) PPARAPTGESALOX5PPARGFOLH1

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-4970023-A Biphenyl compounds, method of producing the same as well as liquid crystal compositions and light switch elements each containing the same NIPPON MINING CO., LTD. (JP) 1990-11-13 US disclosed
EP-0342666-A2 Novel biphenyl compounds, method of producing the same as well as liquid crystal compositions and light switching elements each containing the same JAPAN ENERGY CORPORATION (JP) 1989-11-23 EP disclosed