SCHEMBL13523932

SCHEMBL13523932

CCCCCC(CC)(c1ccc(N)cc1)c1ccc(N)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.48
ESR2 Q92731 6/20 0.48
CNR2 P34972 7/20 0.47
CNR1 P21554 6/20 0.47
MAPT P10636 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 1/20 0.37
AR P10275 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
PDE4D Q08499 1/20 0.35

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
SCHEMBL13523934 0.98 CNR2 (0.49) ESR1ESR2CNR2CNR1MAPT
SCHEMBL13523933 0.94 ESR1 (0.55) ESR1ESR2CNR2CNR1MAPT
SCHEMBL9506262 0.90 MAPT (0.57) ESR1ESR2CNR2CNR1MAPT
SCHEMBL9505321 0.89 MAPT (0.55) ESR1ESR2CNR2CNR1MAPT
SCHEMBL9506249 0.89 MAPT (0.55) ESR1ESR2CNR2CNR1MAPT
SCHEMBL9503281 0.89 MAPT (0.55) ESR1ESR2CNR2CNR1MAPT
SCHEMBL9504010 0.89 MAPT (0.55) ESR1ESR2CNR2CNR1MAPT
SCHEMBL13523938 0.86 ESR1 (0.64) ESR1ESR2CNR2CNR1MAPT
SCHEMBL13523930 0.86 ESR1 (0.52) ESR1ESR2CNR2CNR1MAPT
SCHEMBL8540208 0.84 MAPT (0.58) ESR1ESR2MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230200218-A1 LIGHT-EMITTING DEVICE INCLUDING AMINE COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE AMINE COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed
US-20230200218-A1 LIGHT-EMITTING DEVICE INCLUDING AMINE COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE AMINE COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed
EP-2049599-B1 BASIC BISAZO COMPOUNDS ARCHROMA IP GMBH (CH) 2017-02-22 EP disclosed
US-8921564-B2 Basic bisazo compounds CLARIANT FINANCE (BVI) LTD. (VG) 2014-12-30 US disclosed
US-8921564-B2 Basic bisazo compounds CLARIANT FINANCE (BVI) LTD. (VG) 2014-12-30 US disclosed
US-20100000033-A1 Basic Bisazo Compounds CLARIANT FINANCE (BVI) LIMITED (VG) 2010-01-07 US disclosed
US-20100000033-A1 Basic Bisazo Compounds CLARIANT FINANCE (BVI) LIMITED (VG) 2010-01-07 US disclosed
WO-2008012322-A1 BASIC BISAZO COMPOUNDS CLARIANT INTERNATIONAL LTD (CH) 2008-01-31 WO 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-20230200218-A1 LIGHT-EMITTING DEVICE INCLUDING AMINE COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE AMINE COMPOUND SLC18A1, CRY1, AADAT ESR1 52/4885ESR2 328/4885CNR2 1437/4885

“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.