SCHEMBL21020293

SCHEMBL21020293

Cc1ccc(N(C)c2cccc3c2oc2c(C(F)(F)F)cccc23)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
ACP1 P24666 1/20 0.31
ELANE P08246 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
ALOX12 P18054 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30

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
SCHEMBL21020285 0.89 MEN1 (0.30) MEN1LMNAMAPTKMT2AGPR55
SCHEMBL20172835 0.87 ACP1 (0.33) ACP1ELANEALDH1A1MEN1MAPT
SCHEMBL20650495 0.86 NR1H2 (0.33) NR1H2NR1H3ELANE
SCHEMBL23967662 0.84 CYP1A2 (0.38) SMN1; SMN2ALDH1A1TP53LMNAMAPT
SCHEMBL21020447 0.83 CYP1A2 (0.32)
SCHEMBL21020294 0.83 HDAC6 (0.32) ACP1ALDH1A1
SCHEMBL20172837 0.83 ACP1 (0.35) ACP1MEN1KMT2A
SCHEMBL21021478 0.80 CYP1A2 (0.31)
SCHEMBL21020264 0.79 LMNA (0.39) ALDH1A1TP53MEN1LMNAMAPT
SCHEMBL20172842 0.79 ACP1 (0.33) ACP1MEN1KMT2A

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 NR1H2 1574/4885NR1H3 1237/4885ACP1 4663/4885

“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.