SCHEMBL6546351

SCHEMBL6546351

C=C(c1ccc(C)cc1)c1ccc(C(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
SCN5A Q14524 1/20 0.44
SCN2A Q99250 1/20 0.44
CYP2C9 P11712 1/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
USP5 P45974 1/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TYR P14679 1/20 0.38
TRPA1 O75762 1/20 0.38
PTGS1 P23219 1/20 0.38
CACNA1C Q13936 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
SCHEMBL893597 0.83 HTT (0.55) HTTMAPTGFERHSD17B10GPR55
SCHEMBL4412916 0.83 HTT (0.55) HTTMAPTGFERHSD17B10GPR55
SCHEMBL10441614 0.83 HTT (0.65) HTTCYP2C9MAPTGFERHSD17B10
SCHEMBL6547367 0.83 MEN1 (0.53) HTTCYP2C9MAPTGFERHSD17B10
P-Cymene SCHEMBL1073347 0.81 ACHE (0.47) HTTSCN5ASCN2ACYP2C9USP5
P-Cymene SCHEMBL1143 0.81 ACHE (0.53) HTTSCN5ASCN2ALMNATYR
P-Cymene SCHEMBL1697748 0.81 ACHE (0.53) HTTSCN5ASCN2ALMNATYR
SCHEMBL717192 0.79 HTT (0.52) HTTSCN5ASCN2ACYP2C9MAPT
SCHEMBL9717427 0.79 ALDH1A1 (0.38) HTTMAPTGFERHSD17B10GPR55
SCHEMBL9715740 0.79 PTGS2 (0.50) CYP2C9ALDH1A1LMNACES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230137943-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS THE UNIVERSITY OF CHICAGO 2023-05-04 US disclosed
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230137943-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS PPIA, S100A4, S100A6 HTT 3285/4885SCN5A 4840/4885SCN2A 4618/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.