SCHEMBL15624140

SCHEMBL15624140

O=C1OC/C=C/CCCC(=O)N2CCC[C@H]2C(=O)OC/C=C/CCCC(=O)N2CCC[C@@H]12

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 4/20 0.44
▸ MAPT P10636 1/20 0.44
▸ CYP2D6 P10635 2/20 0.42
▸ CYP3A4 P08684 3/20 0.41
▸ CYP2C9 P11712 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ MGLL Q99685 1/20 0.34
▸ ATM Q13315 2/20 0.33
▸ CHRM1 P11229 1/20 0.33
▸ FKBP4 Q02790 3/20 0.33

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
SCHEMBL15624130 1.00 CYP2C19 (0.44) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL15624107 0.94 CYP2C19 (0.43) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL15624124 0.94 CYP2C19 (0.43) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL15624154 0.94 CYP2C19 (0.43) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL15624150 0.93 CYP2C19 (0.45) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL5492566 0.92 CYP2C19 (0.47) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL5492561 0.92 CYP2C19 (0.47) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL5491076 0.85 CYP2C19 (0.44) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL5491087 0.85 CYP2C19 (0.44) CYP2C19MAPTCYP2D6CYP3A4CYP2C9
SCHEMBL15624120 0.84 FKBP4 (0.44) CYP2C19MAPTCYP2D6CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150322079-A1 LOW CATALYST LOADING IN METATHESIS REACTIONS EVONIK INDUSTRIES AG (DE) 2015-11-12 — — US disclosed
US-20150322079-A1 LOW CATALYST LOADING IN METATHESIS REACTIONS EVONIK INDUSTRIES AG (DE) 2015-11-12 — — US disclosed
EP-2711351-A1 Low catalyst loading in metathesis reactions Evonik Industries AG (DE) 2014-03-26 — — 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-20150322079-A1 LOW CATALYST LOADING IN METATHESIS REACTIONS APEX1, PMS2, MAX CYP2C19 1255/4885MAPT 3210/4885CYP2D6 546/4885

“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.

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