SCHEMBL22945593

SCHEMBL22945593

c1cncc(-c2nc(-c3ccc(N4c5ccccc5-c5cccc6cccc4c56)cc3)nc3c2oc2ccccc23)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.43
ALDH1A1 P00352 9/20 0.43
TSHR P16473 6/20 0.43
KMT2A Q03164 6/20 0.43
MEN1 O00255 5/20 0.43
HSD17B10 Q99714 4/20 0.43
NPSR1 Q6W5P4 4/20 0.43
MAPK1 P28482 2/20 0.43
ALOX12 P18054 1/20 0.43
PDE6D O43924 1/20 0.38
KDM4E B2RXH2 5/20 0.37
POLB P06746 3/20 0.37
LMNA P02545 5/20 0.36
HPGD P15428 4/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 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
SCHEMBL21515315 0.93 MAPT (0.41) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22945730 0.91 MAPT (0.40) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22946057 0.91 MAPT (0.40) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22945570 0.88 PDE6D (0.35) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22944724 0.87 MAPT (0.39) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22944979 0.85 PDE6D (0.36) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22945571 0.85 PDE6D (0.35) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22945594 0.82 MAPK9 (0.33) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22944937 0.82 PDE6D (0.34) MAPTALDH1A1TSHRKMT2AMEN1
SCHEMBL22945423 0.79 PDE6D (0.46) MAPTALDH1A1TSHRKMT2AMEN1

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-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-04 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-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, DRD3, DRD2 MAPT 2771/4885ALDH1A1 271/4885TSHR 716/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 MAPT 2771/4885ALDH1A1 271/4885TSHR 716/4885

“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.