SCHEMBL16499669

SCHEMBL16499669

C=Cc1ccc(/C=C/c2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.78
TSHR P16473 1/20 0.78
MAOB P27338 3/20 0.56
NFE2L2 Q16236 2/20 0.56
CYP19A1 P11511 2/20 0.56
MAOA P21397 2/20 0.56
RELA Q04206 3/20 0.50
TRPA1 O75762 2/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CHAT P28329 2/20 0.46
HDAC1 Q13547 1/20 0.45
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44

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
SCHEMBL368442 1.00 ALDH1A1 (0.78) ALDH1A1TSHRMAOBNFE2L2CYP19A1
(Z)-1,2-Diphenylethene SCHEMBL27498688 0.97 ALDH1A1 (0.82) ALDH1A1TSHRMAOBNFE2L2CYP19A1
(Z)-1,2-Diphenylethene SCHEMBL28371714 0.94 ALDH1A1 (0.78) ALDH1A1TSHRMAOBNFE2L2CYP19A1
SCHEMBL10381868 0.93 ALDH1A1 (0.67) ALDH1A1TSHRMAOBNFE2L2CYP19A1
SCHEMBL10381869 0.93 ALDH1A1 (0.67) ALDH1A1TSHRMAOBNFE2L2CYP19A1
Styrene SCHEMBL490169 0.91 ALDH1A1 (0.93) ALDH1A1TSHRMAOBNFE2L2CYP19A1
Styrene SCHEMBL369036 0.88 ALDH1A1 (1.00) ALDH1A1TSHRMAOBNFE2L2CYP19A1
Styrene SCHEMBL11144289 0.88 ALDH1A1 (1.00) ALDH1A1TSHRMAOBNFE2L2CYP19A1
Styrene SCHEMBL6258482 0.88 ALDH1A1 (1.00) ALDH1A1TSHRMAOBNFE2L2CYP19A1
Styrene SCHEMBL4986035 0.88 ALDH1A1 (1.00) ALDH1A1TSHRMAOBNFE2L2CYP19A1

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
EP-2840076-B1 BICYCLIC COMPOUND TOA EIYO LTD (JP) 2017-10-25 EP disclosed
CN-104245663-B Bicyclic compounds 东亚荣养株式会社 2016-10-26 CN disclosed
US-9290440-B2 Bicyclic compound TOA EIYO LTD. (JP) 2016-03-22 US disclosed
US-20150119418-A1 BICYCLIC COMPOUND TOA EIYO LTD. (JP) 2015-04-30 US disclosed
EP-2840076-A1 BICYCLIC COMPOUND TOA Eiyo Ltd. (JP) 2015-02-25 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-20150119418-A1 BICYCLIC COMPOUND C1S, C1R, CYP11B2 ALDH1A1 2350/4885TSHR 2380/4885MAOB 1357/4885

“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.