SCHEMBL20172841

SCHEMBL20172841

CCc1ccccc1N(C)c1cccc2c1oc1c(C(F)(F)F)cccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLQ O75417 1/20 0.36
ESR1 P03372 1/20 0.34
NR3C1 P04150 1/20 0.32
ACHE P22303 1/20 0.32
AR P10275 1/20 0.32
PTGER1 P34995 1/20 0.32
NPY1R P25929 1/20 0.32
NPY5R Q15761 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ACP1 P24666 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 2/20 0.31
HCAR2 Q8TDS4 1/20 0.31
NPC1 O15118 1/20 0.31
IDO1 P14902 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
SCHEMBL21021441 0.90 ESR1 (0.37) POLQESR1NR3C1ACHEAR
SCHEMBL20172825 0.88 CYP1A2 (0.33) ACHELMNASLC6A2SLC6A4KMT2A
SCHEMBL20172837 0.86 ACP1 (0.35) ESR1ACP1KMT2AKDM4EMEN1
SCHEMBL20650126 0.86 ESR1 (0.34) POLQESR1NR3C1ARPTGER1
SCHEMBL21021446 0.85 ALOX5 (0.38) ARPTGER1LMNAKMT2AKDM4E
SCHEMBL20172804 0.83 POLB (0.36) PTGER1LMNAKDM4ENPC1ALDH1A1
SCHEMBL20172838 0.83 ACP1 (0.33) NR3C1ACP1KMT2AMEN1NR1H2
SCHEMBL20172842 0.83 ACP1 (0.33) ACP1KMT2AMEN1
SCHEMBL20172835 0.83 ACP1 (0.33) ARACP1KMT2AMEN1MAPT
SCHEMBL20172794 0.81 MCL1 (0.37) PTGER1SMN1; SMN2KMT2AMEN1MAPT

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 3 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-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 (2 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 POLQ 3946/4885ESR1 48/4885NR3C1 2221/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 POLQ 3946/4885ESR1 48/4885NR3C1 2221/4885

“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.