SCHEMBL2137795

SCHEMBL2137795

[CH](C=C1C=CCCC1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 1/20 0.32
F3 P13726 1/20 0.32
HTT P42858 1/20 0.31
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL11294752 0.70 CYP1A2 (0.43) ALDH1A1CYP1A2F3HTTGAA
SCHEMBL11540868 0.70
SCHEMBL11540866 0.70
SCHEMBL9500890 0.70
Styrene SCHEMBL9007792 0.69 ALDH1A1 (0.45) ALDH1A1CYP1A2F3HTTGAA
SCHEMBL28144614 0.66 MAPT (0.50) ALDH1A1HTT
SCHEMBL28144612 0.66 MAPT (0.50) ALDH1A1HTT
SCHEMBL2887461 0.66 MAOB (0.31)
SCHEMBL485263 0.66
SCHEMBL485261 0.66 TSHR (0.35) POLB

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-9464164-B2 Method for the preparation of polyesters LANXESS DEUTSCHLAND GMBH (DE) 2016-10-11 US disclosed
US-20120101252-A1 STABILIZATION OF POLYOLS LANXESS DEUTSCHLAND GMBH (DE) 2012-04-26 US 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-20120101252-A1 STABILIZATION OF POLYOLS PUF60, PCBP1, PHOSPHO1 ALDH1A1 3652/4885CYP1A2 3336/4885F3 2671/4885

“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.