SCHEMBL21021053

SCHEMBL21021053

CC(C)c1cccc2c1sc1c(N(C)c3ccccc3OC(F)(F)F)cccc12

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 2/20 0.39
KCNK9 Q9NPC2 2/20 0.39
SIGMAR1 Q99720 1/20 0.31
ACP1 P24666 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
SCHEMBL20649786 0.87 KCNK3 (0.38) KCNK3KCNK9
SCHEMBL20172891 0.84 TRPA1 (0.31) ACP1
SCHEMBL20172882 0.84 SCN9A (0.32) ACP1
SCHEMBL20172919 0.83 HSD11B1 (0.36) ACP1
SCHEMBL20172867 0.83 GPR3 (0.33) ACP1
SCHEMBL21020587 0.82 ACP1 (0.37) ACP1
SCHEMBL20172910 0.82 HTR6 (0.32)
SCHEMBL21021048 0.81 P2RX7 (0.35) SIGMAR1ACP1
SCHEMBL21021482 0.81 SLC6A3 (0.36)
SCHEMBL20172943 0.81 EPHX2 (0.32) ACP1

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-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2019-05-23 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-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ETV6, ESR1 KCNK3 1485/4885KCNK9 524/4885SIGMAR1 2480/4885

“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.