SCHEMBL20172851

SCHEMBL20172851

Cc1ccccc1N(C)c1cccc2c1oc1c(C3CCCCC3)cccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
CEL P19835 2/20 0.34
HTR2C P28335 4/20 0.33
HTR1A P08908 1/20 0.33
HTR7 P34969 1/20 0.33
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
NSD2 O96028 1/20 0.31
MPI P34949 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
HTR1D P28221 2/20 0.31
HTR1B P28222 2/20 0.31
CYP1B1 Q16678 1/20 0.31
PTGS2 P35354 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
SCHEMBL20172854 0.91 CEL (0.36) CELHTR1AHTR7MEN1KMT2A
SCHEMBL20172805 0.90 CEL (0.34) LMNACELHTR2CHTR1AHTR7
SCHEMBL21020443 0.88 PSMB5 (0.33) CELHTR1AHTR7KMT2A
SCHEMBL20172845 0.86 CEL (0.33) CELHTR1AHTR7MEN1KMT2A
SCHEMBL20650327 0.86 LMNA (0.34) LMNACELHTR2CHTR1AHTR7
SCHEMBL20800844 0.86 HTR1A (0.36) CELHTR1AHTR7MEN1KMT2A
SCHEMBL20172853 0.85 CEL (0.33) CELHTR1AHTR7MEN1KMT2A
SCHEMBL15852227 0.85 CYP1B1 (0.33) LMNACELHTR2CCYP1B1
SCHEMBL20800837 0.85 HTR1A (0.36) CELHTR1AHTR7MEN1KMT2A
SCHEMBL20172849 0.84 CEL (0.32) LMNACELHTR1AHTR7

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
US-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 US disclosed
US-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2019-05-23 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 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 (3 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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 LMNA 4253/4885CEL 3965/4885HTR2C 2681/4885
US-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ETV6, ESR1 LMNA 3923/4885CEL 3495/4885HTR2C 2958/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 LMNA 4253/4885CEL 3965/4885HTR2C 2681/4885

“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.