SCHEMBL20148245

SCHEMBL20148245

c1ccc2c(c1)CCCN2CCCC(CCCN1CCCc2ccccc21)CCCN1CCCc2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
USP2 O75604 1/20 0.56
CDK4 P11802 1/20 0.56
ALOX15 P16050 1/20 0.56
CCND1 P24385 1/20 0.56
CHRM2 P08172 12/20 0.54
CHRM4 P08173 12/20 0.54
CHRM1 P11229 12/20 0.54
CHRM3 P20309 11/20 0.54
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
PARP2 Q9UGN5 1/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL20148244 0.86 ALDH1A1 (0.70) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL7951597 0.84 ALDH1A1 (0.77) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL5658763 0.82 ALDH1A1 (0.64) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL30433983 0.82 ALDH1A1 (0.79) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL18263330 0.82 ALDH1A1 (0.64) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL6882714 0.82 ALDH1A1 (0.79) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL30503814 0.82 ALDH1A1 (0.64) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL5638347 0.82 ALDH1A1 (0.64) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL1450283 0.81 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL29555396 0.81 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AUSP2CDK4

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-20180135187-A1 Corrosion Inhibition SCHLUMBERGER TECHNOLOGY CORPORATION 2018-05-17 US disclosed
US-20180135187-A1 Corrosion Inhibition SCHLUMBERGER TECHNOLOGY CORPORATION 2018-05-17 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-20180135187-A1 Corrosion Inhibition SOD1, AOC1, NOX1 ALDH1A1 1550/4885MEN1 1708/4885KMT2A 1317/4885

“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.