SCHEMBL22317809

SCHEMBL22317809

C=C(C)C(=O)OC(C)CC(OCC(=C)C(=O)OC(c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1)(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MLYCD O95822 14/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NR1H3 Q13133 2/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
NR1H2 P55055 1/20 0.31

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
SCHEMBL18844156 0.81
SCHEMBL15840364 0.78 SMN1; SMN2 (0.47) LMNAHTTNPSR1MLYCDSMN1; SMN2
SCHEMBL24511413 0.75 TSHR (0.34)
SCHEMBL22336446 0.71 TSHR (0.37)
SCHEMBL10396191 0.71 NPSR1 (0.37) LMNAHTTNPSR1MLYCDSMN1; SMN2
SCHEMBL24272317 0.70 TSHR (0.36)
SCHEMBL12616447 0.69 TSHR (0.33)
SCHEMBL18850130 0.68 ELANE (0.36) LMNAMLYCDSMN1; SMN2
SCHEMBL10475863 0.68 TSHR (0.34)
SCHEMBL24221406 0.66 NR1H2 (0.45) LMNAMLYCDSMN1; SMN2NR1H3NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200247926-A1 POLYMERIZABLE MONOMER, POLYMER COMPOUND FOR CONDUCTIVE POLYMER, AND METHOD FOR PRODUCING THE POLYMER COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-08-06 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-20200247926-A1 POLYMERIZABLE MONOMER, POLYMER COMPOUND FOR CONDUCTIVE POLYMER, AND METHOD FOR PRODUCING THE POLYMER COMPOUND HCN4, HCN2, HCN3 LMNA 1832/4885HTT 1056/4885NPSR1 1484/4885

“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.