SCHEMBL18640563

SCHEMBL18640563

O=C(O)C1CCC(CCl)O1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
PMP22 Q01453 1/20 0.33
TFPI2 P48307 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
THPO P40225 1/20 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
SCHEMBL22942134 0.80 PMP22 (0.34) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL17916936 0.80 PMP22 (0.34) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL15864539 0.78 SLC6A2 (0.40) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL20908638 0.78 KDM4E (0.33) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL19744361 0.78 LMNA (0.38) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL18820209 0.78 SLC6A2 (0.40) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL21951861 0.78 PPM1B (0.34) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL19784466 0.78 SLC6A2 (0.40) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL11847019 0.78 CYP1A2 (0.34) KDM4EGMNNLMNAPMP22TFPI2
SCHEMBL11847024 0.78 CYP1A2 (0.34) KDM4EGMNNLMNAPMP22TFPI2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10392358-B2 Oxidation chemistry on furan aldehydes MICROMIDAS, INC. (US) 2019-08-27 US disclosed
US-10392358-B2 Oxidation chemistry on furan aldehydes MICROMIDAS, INC. (US) 2019-08-27 US disclosed
US-20180265488-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES MICROMIDAS, INC. (US) 2018-09-20 US disclosed
CN-108349920-A OXIDATION CHEMISTRY ON FURAN ALDEHYDES 微麦德斯公司 2018-07-31 CN disclosed
WO-2017049211-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES MICROMIDAS, INC. (US) 2017-03-23 WO disclosed
WO-2017049211-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES MICROMIDAS, INC. (US) 2017-03-23 WO 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 (2 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-10392358-B2 Oxidation chemistry on furan aldehydes AOX1, ALOX5, CBR1 ALDH1A1 31/4885TDP1 2488/4885KDM4E 1169/4885
US-20180265488-A1 OXIDATION CHEMISTRY ON FURAN ALDEHYDES AOX1, ALOX5, CBR1 ALDH1A1 31/4885TDP1 2488/4885KDM4E 1169/4885

“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.