SCHEMBL16754245

SCHEMBL16754245

OCCCOCCCNC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
CXCR4 P61073 4/20 0.42
ALDH1A1 P00352 4/20 0.42
CXCL12 P48061 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
EPHX1 P07099 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
HTR1A P08908 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL16754271 0.98 KDM4E (0.47) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754246 0.94 EPHX1 (0.44) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754263 0.94 KDM4E (0.45) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754266 0.92 KDM4E (0.46) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754273 0.92 KDM4E (0.46) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754262 0.92 ALDH1A1 (0.42) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754272 0.92 SMN1; SMN2 (0.44) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754249 0.91 EPHX1 (0.47) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754236 0.90 SMN1; SMN2 (0.45) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2
SCHEMBL16754261 0.90 KDM4E (0.47) KDM4ECXCR4ALDH1A1CXCL12SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2883591-B1 ACID GAS ABSORBENT, ACID GAS REMOVAL DEVICE, AND ACID GAS REMOVAL METHOD TOSHIBA KK (JP) 2019-05-29 EP disclosed
US-9724642-B2 Acid gas absorbent, acid gas removal device, and acid gas removal method KABUSHIKI KAISHA TOSHIBA (JP) 2017-08-08 US disclosed
EP-2883591-A1 Acid gas absorbent, acid gas removal device, and acid gas removal method Kabushiki Kaisha Toshiba (JP) 2015-06-17 EP disclosed
US-20150151246-A1 ACID GAS ABSORBENT, ACID GAS REMOVAL DEVICE, AND ACID GAS REMOVAL METHOD KABUSHIKI KAISHA TOSHIBA (JP) 2015-06-04 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-20150151246-A1 ACID GAS ABSORBENT, ACID GAS REMOVAL DEVICE, AND ACID GAS REMOVAL METHOD ALKBH1, ALKBH3, GPBAR1 KDM4E 1875/4885CXCR4 2960/4885ALDH1A1 389/4885

“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.